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CHEBI:747147 - 3-oxo-(2S,6R,10R)-trimethyl-hendecanoyl-CoA(4-)
| Formula | C35H56N7O18P3S |
| Net Charge | -4 |
| Average Mass | 987.853 |
| Monoisotopic Mass | 987.26373 |
| SMILES | CC(C)CCC[C@H](C)CCC(=O)[C@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-] |
| InChI | InChI=1S/C35H60N7O18P3S/c1-20(2)8-7-9-21(3)10-11-23(43)22(4)34(48)64-15-14-37-25(44)12-13-38-32(47)29(46)35(5,6)17-57-63(54,55)60-62(52,53)56-16-24-28(59-61(49,50)51)27(45)33(58-24)42-19-41-26-30(36)39-18-40-31(26)42/h18-22,24,27-29,33,45-46H,7-17H2,1-6H3,(H,37,44)(H,38,47)(H,52,53)(H,54,55)(H2,36,39,40)(H2,49,50,51)/p-4/t21-,22-,24+,27+,28+,29-,33+/m0/s1 |
| InChIKey | PNNFJGGYIRMCJJ-QFPBMTAQSA-J |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-oxo-(2S,6R,10R)-trimethyl-hendecanoyl-CoA(4-) (CHEBI:747147) is a organic molecular entity (CHEBI:50860) |