Difference between revisions of "CPD-19159"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=ACONITATEDEHYDR-RXN ACONITATEDEHYDR-RXN] == * direction: ** REVERSIBLE * common name: ** Aconitate...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4578 CPD-4578] == * smiles: ** CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=ACONITATEDEHYDR-RXN ACONITATEDEHYDR-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4578 CPD-4578] ==
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* direction:
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* smiles:
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** REVERSIBLE
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** CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))
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* inchi key:
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** InChIKey=DBPZYKHQDWKORQ-SINUOACOSA-N
 
* common name:
 
* common name:
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** Aconitate hydratase,
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** 3-dehydro-4-methylzymosterol
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** Aconitase/3-isopropylmalate dehydratase, swivel
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* molecular weight:
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** 396.655   
 
* Synonym(s):
 
* Synonym(s):
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** 4α-methyl-5α-cholesta-8,24-dien-3-one
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** 3-keto-4-methylzymosterol
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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== Reaction(s) known to produce the compound ==
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** 1 [[CIT]][c] '''<=>''' 1 [[CIS-ACONITATE]][c] '''+''' 1 [[WATER]][c]
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* [[RXN66-313]]
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 citrate[c] '''<=>''' 1 cis-aconitate[c] '''+''' 1 H2O[c]
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== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* [[Ec-12_000170]]
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** ESILICULOSUS_GENOME
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***AUTOMATED-NAME-MATCH
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* [[Ec-16_001000]]
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** ESILICULOSUS_GENOME
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***EC-NUMBER
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== Pathways  ==
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* [[PWY-5750]], itaconate biosynthesis: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5750 PWY-5750]
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** '''3''' reactions found over '''4''' reactions in the full pathway
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* [[PWY-5913]], partial TCA cycle (obligate autotrophs): [http://metacyc.org/META/NEW-IMAGE?object=PWY-5913 PWY-5913]
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** '''10''' reactions found over '''11''' reactions in the full pathway
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* [[PWY-6969]], TCA cycle V (2-oxoglutarate:ferredoxin oxidoreductase): [http://metacyc.org/META/NEW-IMAGE?object=PWY-6969 PWY-6969]
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** '''10''' reactions found over '''12''' reactions in the full pathway
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* [[REDCITCYC]], TCA cycle VIII (helicobacter): [http://metacyc.org/META/NEW-IMAGE?object=REDCITCYC REDCITCYC]
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** '''5''' reactions found over '''9''' reactions in the full pathway
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* [[PWY-5392]], reductive TCA cycle II: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5392 PWY-5392]
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** '''6''' reactions found over '''12''' reactions in the full pathway
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* [[P23-PWY]], reductive TCA cycle I: [http://metacyc.org/META/NEW-IMAGE?object=P23-PWY P23-PWY]
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** '''10''' reactions found over '''12''' reactions in the full pathway
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* [[PWY-7124]], ethylene biosynthesis V (engineered): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7124 PWY-7124]
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** '''8''' reactions found over '''10''' reactions in the full pathway
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* [[P105-PWY]], TCA cycle IV (2-oxoglutarate decarboxylase): [http://metacyc.org/META/NEW-IMAGE?object=P105-PWY P105-PWY]
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** '''9''' reactions found over '''11''' reactions in the full pathway
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* [[GLYOXYLATE-BYPASS]], glyoxylate cycle: [http://metacyc.org/META/NEW-IMAGE?object=GLYOXYLATE-BYPASS GLYOXYLATE-BYPASS]
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** '''6''' reactions found over '''6''' reactions in the full pathway
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* [[FERMENTATION-PWY]], mixed acid fermentation: [http://metacyc.org/META/NEW-IMAGE?object=FERMENTATION-PWY FERMENTATION-PWY]
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** '''8''' reactions found over '''16''' reactions in the full pathway
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* [[PWY-6728]], methylaspartate cycle: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6728 PWY-6728]
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** '''11''' reactions found over '''18''' reactions in the full pathway
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* [[PWY-6549]], L-glutamine biosynthesis III: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6549 PWY-6549]
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** '''8''' reactions found over '''9''' reactions in the full pathway
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* [[PWY-7254]], TCA cycle VII (acetate-producers): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7254 PWY-7254]
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** '''7''' reactions found over '''9''' reactions in the full pathway
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* [[TCA]], TCA cycle I (prokaryotic): [http://metacyc.org/META/NEW-IMAGE?object=TCA TCA]
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** '''9''' reactions found over '''10''' reactions in the full pathway
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* [[PWY66-398]], TCA cycle III (animals): [http://metacyc.org/META/NEW-IMAGE?object=PWY66-398 PWY66-398]
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** '''10''' reactions found over '''11''' reactions in the full pathway
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* [[PWY-5690]], TCA cycle II (plants and fungi): [http://metacyc.org/META/NEW-IMAGE?object=PWY-5690 PWY-5690]
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** '''8''' reactions found over '''9''' reactions in the full pathway
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== Reconstruction information  ==
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[esiliculosus_genome]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* LIGAND-CPD:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=10228 10228]
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** [http://www.genome.jp/dbget-bin/www_bget?C15816 C15816]
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* PIR:
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* CHEBI:
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=A35544 A35544]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=50593 50593]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=A44153 A44153]
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* METABOLIGHTS : MTBLC50593
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=A44154 A44154]
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* PUBCHEM:
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=A47184 A47184]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=22298939 22298939]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=A81801 A81801]
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* HMDB : HMDB06838
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=B48642 B48642]
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{{#set: smiles=CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))}}
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=C64362 C64362]
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{{#set: inchi key=InChIKey=DBPZYKHQDWKORQ-SINUOACOSA-N}}
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=C64617 C64617]
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{{#set: common name=3-dehydro-4-methylzymosterol}}
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=C81356 C81356]
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{{#set: molecular weight=396.655    }}
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=F64734 F64734]
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{{#set: common name=4&alpha;-methyl-5&alpha;-cholesta-8,24-dien-3-one|3-keto-4-methylzymosterol}}
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=F70873 F70873]
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{{#set: produced by=RXN66-313}}
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=G64875 G64875]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=G69599 G69599]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=G86708 G86708]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=H81775 H81775]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S17526 S17526]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S18720 S18720]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S26403 S26403]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S49849 S49849]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S50387 S50387]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S57528 S57528]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S57805 S57805]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=S76777 S76777]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=T04693 T04693]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=T04820 T04820]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=T07611 T07611]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=T10101 T10101]
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** [http://pir.georgetown.edu/cgi-bin/nbrfget?uid=T52543 T52543]
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* LIGAND-RXN:
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** [http://www.genome.jp/dbget-bin/www_bget?R01325 R01325]
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* UNIPROT:
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** [http://www.uniprot.org/uniprot/P16276 P16276]
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** [http://www.uniprot.org/uniprot/Q01059 Q01059]
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** [http://www.uniprot.org/uniprot/Q9TSA1 Q9TSA1]
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** [http://www.uniprot.org/uniprot/Q9JTI5 Q9JTI5]
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** [http://www.uniprot.org/uniprot/P37032 P37032]
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** [http://www.uniprot.org/uniprot/P81291 P81291]
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** [http://www.uniprot.org/uniprot/Q9PP88 Q9PP88]
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** [http://www.uniprot.org/uniprot/P36683 P36683]
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** [http://www.uniprot.org/uniprot/O53166 O53166]
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** [http://www.uniprot.org/uniprot/P25516 P25516]
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** [http://www.uniprot.org/uniprot/P09339 P09339]
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** [http://www.uniprot.org/uniprot/Q9CHQ5 Q9CHQ5]
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** [http://www.uniprot.org/uniprot/Q9JT05 Q9JT05]
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** [http://www.uniprot.org/uniprot/Q99798 Q99798]
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** [http://www.uniprot.org/uniprot/P28271 P28271]
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** [http://www.uniprot.org/uniprot/P21399 P21399]
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** [http://www.uniprot.org/uniprot/Q42669 Q42669]
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** [http://www.uniprot.org/uniprot/P19414 P19414]
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** [http://www.uniprot.org/uniprot/P20004 P20004]
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** [http://www.uniprot.org/uniprot/P49609 P49609]
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** [http://www.uniprot.org/uniprot/P74582 P74582]
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** [http://www.uniprot.org/uniprot/Q42560 Q42560]
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** [http://www.uniprot.org/uniprot/Q9SZ36 Q9SZ36]
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** [http://www.uniprot.org/uniprot/O04916 O04916]
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{{#set: direction=REVERSIBLE}}
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{{#set: common name=Aconitate hydratase,}}
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{{#set: common name=Aconitase/3-isopropylmalate dehydratase, swivel}}
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{{#set: gene associated=Ec-12_000170|Ec-16_001000}}
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{{#set: in pathway=PWY-5750|PWY-5913|PWY-6969|REDCITCYC|PWY-5392|P23-PWY|PWY-7124|P105-PWY|GLYOXYLATE-BYPASS|FERMENTATION-PWY|PWY-6728|PWY-6549|PWY-7254|TCA|PWY66-398|PWY-5690}}
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{{#set: reconstruction category=annotation}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: reconstruction source=esiliculosus_genome}}
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Revision as of 22:00, 17 March 2018

Metabolite CPD-4578

  • smiles:
    • CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))
  • inchi key:
    • InChIKey=DBPZYKHQDWKORQ-SINUOACOSA-N
  • common name:
    • 3-dehydro-4-methylzymosterol
  • molecular weight:
    • 396.655
  • Synonym(s):
    • 4α-methyl-5α-cholesta-8,24-dien-3-one
    • 3-keto-4-methylzymosterol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC50593
  • PUBCHEM:
  • HMDB : HMDB06838
"CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))" cannot be used as a page name in this wiki.



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