Difference between revisions of "CPD-15368"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15368 CPD-15368] == * smiles: ** CCCCCCC(O)CC=CCCCCCCCC(=O)CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)C...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CCCCCCC(O)CC=CCCCCCCCC(=O)CC(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-])=O | ** CCCCCCC(O)CC=CCCCCCCCC(=O)CC(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-])=O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 1085.989 | ** 1085.989 | ||
| + | * inchi key: | ||
| + | ** InChIKey=NQXRRZBOZBKGIU-MHAUFEDZSA-J | ||
| + | * common name: | ||
| + | ** 3-oxo-lesqueroloyl-CoA | ||
* Synonym(s): | * Synonym(s): | ||
| Line 20: | Line 20: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657339 90657339] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657339 90657339] | ||
{{#set: smiles=CCCCCCC(O)CC=CCCCCCCCC(=O)CC(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-])=O}} | {{#set: smiles=CCCCCCC(O)CC=CCCCCCCCC(=O)CC(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-])=O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=1085.989 }} | {{#set: molecular weight=1085.989 }} | ||
| + | {{#set: inchi key=InChIKey=NQXRRZBOZBKGIU-MHAUFEDZSA-J}} | ||
| + | {{#set: common name=3-oxo-lesqueroloyl-CoA}} | ||
{{#set: consumed by=RXN-14493}} | {{#set: consumed by=RXN-14493}} | ||
{{#set: produced by=RXN-14492}} | {{#set: produced by=RXN-14492}} | ||
Latest revision as of 13:17, 10 January 2019
Contents
Metabolite CPD-15368
- smiles:
- CCCCCCC(O)CC=CCCCCCCCC(=O)CC(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-])=O
- molecular weight:
- 1085.989
- inchi key:
- InChIKey=NQXRRZBOZBKGIU-MHAUFEDZSA-J
- common name:
- 3-oxo-lesqueroloyl-CoA
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
"CCCCCCC(O)CC=CCCCCCCCC(=O)CC(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-])=O" cannot be used as a page name in this wiki.
