Difference between revisions of "Tiso gene 10326"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=OLEATE-CPD OLEATE-CPD] == * smiles: ** CCCCCCCCC=CCCCCCCCC([O-])=O * inchi key: ** InChIKey=ZQP...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DI-H-OROTATE DI-H-OROTATE] == * smiles: ** C1(C(=O)NC(=O)NC(C(=O)[O-])1) * inchi key: ** InChIK...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=OLEATE-CPD OLEATE-CPD] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DI-H-OROTATE DI-H-OROTATE] ==
 
* smiles:
 
* smiles:
−
** CCCCCCCCC=CCCCCCCCC([O-])=O
+
** C1(C(=O)NC(=O)NC(C(=O)[O-])1)
 
* inchi key:
 
* inchi key:
−
** InChIKey=ZQPPMHVWECSIRJ-KTKRTIGZSA-M
+
** InChIKey=UFIVEPVSAGBUSI-REOHCLBHSA-M
 
* common name:
 
* common name:
−
** oleate
+
** (S)-dihydroorotate
 
* molecular weight:
 
* molecular weight:
−
** 281.457    
+
** 157.105    
 
* Synonym(s):
 
* Synonym(s):
−
** oleic acid
+
** dihydro-L-orotate
−
** (9Z)-octadec-9-enoate
+
** (S)-4,5-dihydroorotate
−
** (9Z)-octadecenoate
+
** (S)-4,5-dihydroorotic acid
−
** (9Z)-octadecenoic acid
+
** (S)-hydroorotic acid
−
** (9Z)-octadec-9-enoic acid
+
** (S)-di-H-orotate
−
** (Z)-octadec-9-enoic acid
+
** L-dihydroorotate
−
** 18:1 n-9
+
** 4,5-dihydro-L-orotate
−
** 18:1Δ9cis
+
** L-4,5-dihydroorotate
−
** C18:1 n-9
+
** (S)-4-pyrimidinecarboxylic acid
−
** cis-9-octadecenoic acid
+
−
** cis-Δ9-octadecenoic acid
+
−
** cis-oleic acid
+
−
** octadec-9-enoic acid
+
−
** octadecenoate (n-C18:1)
+
−
** 9-octadecenoic acid
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-9644]]
+
* [[RXN0-6491]]
−
* [[RXN0-7239]]
+
* [[RXN0-6554]]
−
* [[RXN-12776]]
+
* [[DIHYDROOROTATE-DEHYDROGENASE-RXN]]
−
* [[FACOAL18111Z]]
+
* [[RXN-9929]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[3.1.2.14-RXN]]
+
* [[RXN0-6490]]
−
* [[RXN-9666]]
+
−
* [[RXN-15068]]
+
−
* [[RXN-15088]]
+
−
* [[RXN-15067]]
+
−
* [[RXN-15035]]
+
−
* [[RXN-15089]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[DIHYDROOROT-RXN]]
 
== External links  ==
 
== External links  ==
−
* CAS : 112-80-1
+
* CAS : 5988-19-2
−
* METABOLIGHTS : MTBLC30823
+
* CAS : 155-54-4
 +
* METABOLIGHTS : MTBLC30864
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460221 5460221]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460289 5460289]
−
* HMDB : HMDB00207
+
* HMDB : HMDB00528
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C00712 C00712]
+
** [http://www.genome.jp/dbget-bin/www_bget?C00337 C00337]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.4573837.html 4573837]
+
** [http://www.chemspider.com/Chemical-Structure.4573876.html 4573876]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30823 30823]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30864 30864]
−
* BIGG : ocdcea
+
* BIGG : dhor__S
−
{{#set: smiles=CCCCCCCCC=CCCCCCCCC([O-])=O}}
+
{{#set: smiles=C1(C(=O)NC(=O)NC(C(=O)[O-])1)}}
−
{{#set: inchi key=InChIKey=ZQPPMHVWECSIRJ-KTKRTIGZSA-M}}
+
{{#set: inchi key=InChIKey=UFIVEPVSAGBUSI-REOHCLBHSA-M}}
−
{{#set: common name=oleate}}
+
{{#set: common name=(S)-dihydroorotate}}
−
{{#set: molecular weight=281.457   }}
+
{{#set: molecular weight=157.105   }}
−
{{#set: common name=oleic acid|(9Z)-octadec-9-enoate|(9Z)-octadecenoate|(9Z)-octadecenoic acid|(9Z)-octadec-9-enoic acid|(Z)-octadec-9-enoic acid|18:1 n-9|18:1Δ9cis|C18:1 n-9|cis-9-octadecenoic acid|cis-Δ9-octadecenoic acid|cis-oleic acid|octadec-9-enoic acid|octadecenoate (n-C18:1)|9-octadecenoic acid}}
+
{{#set: common name=dihydro-L-orotate|(S)-4,5-dihydroorotate|(S)-4,5-dihydroorotic acid|(S)-hydroorotic acid|(S)-di-H-orotate|L-dihydroorotate|4,5-dihydro-L-orotate|L-4,5-dihydroorotate|(S)-4-pyrimidinecarboxylic acid}}
−
{{#set: consumed by=RXN-9644|RXN0-7239|RXN-12776|FACOAL18111Z}}
+
{{#set: consumed by=RXN0-6491|RXN0-6554|DIHYDROOROTATE-DEHYDROGENASE-RXN|RXN-9929}}
−
{{#set: produced by=3.1.2.14-RXN|RXN-9666|RXN-15068|RXN-15088|RXN-15067|RXN-15035|RXN-15089}}
+
{{#set: produced by=RXN0-6490}}
 +
{{#set: consumed or produced by=DIHYDROOROT-RXN}}

Revision as of 17:49, 10 January 2018

Metabolite DI-H-OROTATE

  • smiles:
    • C1(C(=O)NC(=O)NC(C(=O)[O-])1)
  • inchi key:
    • InChIKey=UFIVEPVSAGBUSI-REOHCLBHSA-M
  • common name:
    • (S)-dihydroorotate
  • molecular weight:
    • 157.105
  • Synonym(s):
    • dihydro-L-orotate
    • (S)-4,5-dihydroorotate
    • (S)-4,5-dihydroorotic acid
    • (S)-hydroorotic acid
    • (S)-di-H-orotate
    • L-dihydroorotate
    • 4,5-dihydro-L-orotate
    • L-4,5-dihydroorotate
    • (S)-4-pyrimidinecarboxylic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 5988-19-2
  • CAS : 155-54-4
  • METABOLIGHTS : MTBLC30864
  • PUBCHEM:
  • HMDB : HMDB00528
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • BIGG : dhor__S
"C1(C(=O)NC(=O)NC(C(=O)[O-])1)" cannot be used as a page name in this wiki.




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