Difference between revisions of "Cis-vaccenoyl-ACPs"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14281 CPD-14281] == * smiles: ** CCCCCCCCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6992 CPD-6992] == * smiles: ** C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3) * inchi k...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14281 CPD-14281] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6992 CPD-6992] ==
 
* smiles:
 
* smiles:
−
** CCCCCCCCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
+
** C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)
−
* common name:
+
−
** trans-docos-2-enoyl-CoA
+
 
* inchi key:
 
* inchi key:
−
** InChIKey=KRTIFNFQCJTGMV-DYAVHEMFSA-J
+
** InChIKey=SUYJZKRQHBQNCA-LSDHHAIUSA-M
 +
* common name:
 +
** (+)-pinobanksin
 
* molecular weight:
 
* molecular weight:
−
** 1084.06    
+
** 271.249    
 
* Synonym(s):
 
* Synonym(s):
−
** trans-2,3-dihydro-docosenoyl-CoA
+
** (2R,3R)-pinobanksin
−
** (2E)-docosenoyl-CoA
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-13307]]
 
−
* [[TRANS-2-ENOYL-COA-REDUCTASE-NAD+-RXN-CPD-10279/NAD//CPD-14281/NADH/PROTON.37.]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-13303]]
+
* [[RXN-7648]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* PUBCHEM:
+
* LIGAND-CPD:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=71627306 71627306]
+
** [http://www.genome.jp/dbget-bin/www_bget?C09826 C09826]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=74692 74692]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28103 28103]
−
{{#set: smiles=CCCCCCCCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O}}
+
* METABOLIGHTS : MTBLC28103
−
{{#set: common name=trans-docos-2-enoyl-CoA}}
+
* PUBCHEM:
−
{{#set: inchi key=InChIKey=KRTIFNFQCJTGMV-DYAVHEMFSA-J}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25200970 25200970]
−
{{#set: molecular weight=1084.06   }}
+
* HMDB : HMDB37506
−
{{#set: common name=trans-2,3-dihydro-docosenoyl-CoA|(2E)-docosenoyl-CoA}}
+
{{#set: smiles=C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)}}
−
{{#set: consumed by=RXN-13307|TRANS-2-ENOYL-COA-REDUCTASE-NAD+-RXN-CPD-10279/NAD//CPD-14281/NADH/PROTON.37.}}
+
{{#set: inchi key=InChIKey=SUYJZKRQHBQNCA-LSDHHAIUSA-M}}
−
{{#set: produced by=RXN-13303}}
+
{{#set: common name=(+)-pinobanksin}}
 +
{{#set: molecular weight=271.249   }}
 +
{{#set: common name=(2R,3R)-pinobanksin}}
 +
{{#set: produced by=RXN-7648}}

Revision as of 13:37, 21 March 2018

Metabolite CPD-6992

  • smiles:
    • C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)
  • inchi key:
    • InChIKey=SUYJZKRQHBQNCA-LSDHHAIUSA-M
  • common name:
    • (+)-pinobanksin
  • molecular weight:
    • 271.249
  • Synonym(s):
    • (2R,3R)-pinobanksin

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 : MTBLC28103
  • PUBCHEM:
  • HMDB : HMDB37506
"C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)" cannot be used as a page name in this wiki.



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