Difference between revisions of "CPD0-2253"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2253 CPD0-2253] == * smiles: ** CCCCCCCCCCCCCCCC(O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-]...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CCCCCCCCCCCCCCCC(O)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 | ** CCCCCCCCCCCCCCCC(O)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 | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 1045.968 | ** 1045.968 | ||
| + | * inchi key: | ||
| + | ** InChIKey=WZMAIEGYXCOYSH-SFKGBVSGSA-J | ||
| + | * common name: | ||
| + | ** (S)-3-hydroxy-stearoyl-CoA | ||
* Synonym(s): | * Synonym(s): | ||
** (S)-3-Hydroxyoctadecanoyl-CoA | ** (S)-3-Hydroxyoctadecanoyl-CoA | ||
| Line 18: | Line 18: | ||
* [[ECOAH8h]] | * [[ECOAH8h]] | ||
== External links == | == External links == | ||
| + | * METABOLIGHTS : MTBLC50577 | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657405 90657405] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657405 90657405] | ||
| Line 23: | Line 24: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87561 87561] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87561 87561] | ||
* BIGG : 3hodcoa | * BIGG : 3hodcoa | ||
| − | |||
{{#set: smiles=CCCCCCCCCCCCCCCC(O)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}} | {{#set: smiles=CCCCCCCCCCCCCCCC(O)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}} | ||
| − | |||
| − | |||
{{#set: molecular weight=1045.968 }} | {{#set: molecular weight=1045.968 }} | ||
| + | {{#set: inchi key=InChIKey=WZMAIEGYXCOYSH-SFKGBVSGSA-J}} | ||
| + | {{#set: common name=(S)-3-hydroxy-stearoyl-CoA}} | ||
{{#set: common name=(S)-3-Hydroxyoctadecanoyl-CoA}} | {{#set: common name=(S)-3-Hydroxyoctadecanoyl-CoA}} | ||
{{#set: consumed by=ECOAH8}} | {{#set: consumed by=ECOAH8}} | ||
{{#set: reversible reaction associated=ECOAH8h}} | {{#set: reversible reaction associated=ECOAH8h}} | ||
Latest revision as of 13:12, 10 January 2019
Contents
Metabolite CPD0-2253
- smiles:
- CCCCCCCCCCCCCCCC(O)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
- molecular weight:
- 1045.968
- inchi key:
- InChIKey=WZMAIEGYXCOYSH-SFKGBVSGSA-J
- common name:
- (S)-3-hydroxy-stearoyl-CoA
- Synonym(s):
- (S)-3-Hydroxyoctadecanoyl-CoA
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"CCCCCCCCCCCCCCCC(O)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" cannot be used as a page name in this wiki.
