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CHEBI:142398 - trans-2,4-dihydroxy-cinnamoyl-CoA(4−)
| Formula | C30H38N7O19P3S |
| Net Charge | -4 |
| Average Mass | 925.653 |
| Monoisotopic Mass | 925.11780 |
| SMILES | CC(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-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)/C=C/c1ccc(O)cc1O |
| InChI | InChI=1S/C30H42N7O19P3S/c1-30(2,25(43)28(44)33-8-7-20(40)32-9-10-60-21(41)6-4-16-3-5-17(38)11-18(16)39)13-53-59(50,51)56-58(48,49)52-12-19-24(55-57(45,46)47)23(42)29(54-19)37-15-36-22-26(31)34-14-35-27(22)37/h3-6,11,14-15,19,23-25,29,38-39,42-43H,7-10,12-13H2,1-2H3,(H,32,40)(H,33,44)(H,48,49)(H,50,51)(H2,31,34,35)(H2,45,46,47)/p-4/b6-4+/t19-,23-,24-,25+,29-/m1/s1 |
| InChIKey | PGFXNMKOJHFQIE-ZSELIEHESA-J |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| trans-2,4-dihydroxy-cinnamoyl-CoA(4−) (CHEBI:142398) is a acyl-CoA(4−) (CHEBI:58342) |
| UniProt Name | Source |
|---|---|
| (E)-2,4-dihydroxycinnamoyl-CoA | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-14010 | MetaCyc |