Difference between revisions of "CPD-11528"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11528 CPD-11528] == * smiles: ** CCC=CCC4(C(=O)CCC(CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)...") |
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11528 CPD-11528] == | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11528 CPD-11528] == | ||
* smiles: | * smiles: | ||
| − | ** CCC= | + | ** CCC=CCC1(C(CCC(=O)1)CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]) |
| − | + | ||
| − | + | ||
| − | + | ||
| − | + | ||
* molecular weight: | * molecular weight: | ||
** 997.797 | ** 997.797 | ||
| + | * inchi key: | ||
| + | ** InChIKey=QGJLCXXJEFRWHP-JQUKJZMASA-J | ||
| + | * common name: | ||
| + | ** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3-oxobutanoyl)-CoA | ||
* Synonym(s): | * Synonym(s): | ||
| + | ** OPC4-3-ketoacyl-CoA | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| Line 18: | Line 19: | ||
== External links == | == External links == | ||
* PUBCHEM: | * PUBCHEM: | ||
| − | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid= | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=126961198 126961198] |
| − | {{#set: smiles=CCC= | + | {{#set: smiles=CCC=CCC1(C(CCC(=O)1)CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-])}} |
| − | + | ||
| − | + | ||
{{#set: molecular weight=997.797 }} | {{#set: molecular weight=997.797 }} | ||
| + | {{#set: inchi key=InChIKey=QGJLCXXJEFRWHP-JQUKJZMASA-J}} | ||
| + | {{#set: common name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3-oxobutanoyl)-CoA}} | ||
| + | {{#set: common name=OPC4-3-ketoacyl-CoA}} | ||
{{#set: consumed by=RXN-10701}} | {{#set: consumed by=RXN-10701}} | ||
{{#set: produced by=RXN-10703}} | {{#set: produced by=RXN-10703}} | ||
Latest revision as of 14:42, 10 January 2019
Contents
Metabolite CPD-11528
- smiles:
- CCC=CCC1(C(CCC(=O)1)CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-])
- molecular weight:
- 997.797
- inchi key:
- InChIKey=QGJLCXXJEFRWHP-JQUKJZMASA-J
- common name:
- 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3-oxobutanoyl)-CoA
- Synonym(s):
- OPC4-3-ketoacyl-CoA
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
"CCC=CCC1(C(CCC(=O)1)CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-])" cannot be used as a page name in this wiki.
