Difference between revisions of "Ec-27 002020"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6994 CPD-6994] == * smiles: ** C3(C(C2(OC1(C=C(C=C(C=1C(C2)=O)O)[O-])))=CC(=C(C=3)O)O) * in...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19171 CPD-19171] == * smiles: ** CCCCCCCCC=CCCCCCC(O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6994 CPD-6994] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19171 CPD-19171] ==
 
* smiles:
 
* smiles:
** C3(C(C2(OC1(C=C(C=C(C=1C(C2)=O)O)[O-])))=CC(=C(C=3)O)O)
+
** CCCCCCCCC=CCCCCCC(O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
 
* inchi key:
 
* inchi key:
** InChIKey=SBHXYTNGIZCORC-ZDUSSCGKSA-M
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** InChIKey=LHAYYTCFPMUQNR-DFXYPYGHSA-J
 
* common name:
 
* common name:
** (2S)-eriodictyol
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** (S)-3-hydroxy-(9Z)-octadecenoyl-CoA
 
* molecular weight:
 
* molecular weight:
** 287.248    
+
** 1043.952    
 
* Synonym(s):
 
* Synonym(s):
 +
** (S)-3-hydroxy-18:1-Δ9-CoA
 +
** (S)-3-hydroxy-9-cis-octadecenoyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-7775]]
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* [[RXN-17777]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-17776]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* PUBCHEM:
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{{#set: smiles=CCCCCCCCC=CCCCCCC(O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]}}
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657147 90657147]
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{{#set: inchi key=InChIKey=LHAYYTCFPMUQNR-DFXYPYGHSA-J}}
* CHEBI:
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{{#set: common name=(S)-3-hydroxy-(9Z)-octadecenoyl-CoA}}
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28412 28412]
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{{#set: molecular weight=1043.952   }}
* LIGAND-CPD:
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{{#set: common name=(S)-3-hydroxy-18:1-Δ9-CoA|(S)-3-hydroxy-9-cis-octadecenoyl-CoA}}
** [http://www.genome.jp/dbget-bin/www_bget?C05631 C05631]
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{{#set: consumed by=RXN-17777}}
* HMDB : HMDB05810
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{{#set: produced by=RXN-17776}}
{{#set: smiles=C3(C(C2(OC1(C=C(C=C(C=1C(C2)=O)O)[O-])))=CC(=C(C=3)O)O)}}
+
{{#set: inchi key=InChIKey=SBHXYTNGIZCORC-ZDUSSCGKSA-M}}
+
{{#set: common name=(2S)-eriodictyol}}
+
{{#set: molecular weight=287.248   }}
+
{{#set: consumed by=RXN-7775}}
+

Revision as of 23:00, 17 March 2018

Metabolite CPD-19171

  • smiles:
    • CCCCCCCCC=CCCCCCC(O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
  • inchi key:
    • InChIKey=LHAYYTCFPMUQNR-DFXYPYGHSA-J
  • common name:
    • (S)-3-hydroxy-(9Z)-octadecenoyl-CoA
  • molecular weight:
    • 1043.952
  • Synonym(s):
    • (S)-3-hydroxy-18:1-Δ9-CoA
    • (S)-3-hydroxy-9-cis-octadecenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCC=CCCCCCC(O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-" cannot be used as a page name in this wiki.