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CHEBI:232249 - 7-oxotyraminolithocholic acid
| Formula | C34H48N2O3 |
| Net Charge | 0 |
| Average Mass | 532.769 |
| Monoisotopic Mass | 532.36649 |
| SMILES | C[C@H](CCC(=O)NCCc1cnc2ccccc12)[C@H]1CC[C@H]2[C@@H]3C(=O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |
| InChI | InChI=1S/C34H48N2O3/c1-21(8-11-31(39)35-17-14-22-20-36-29-7-5-4-6-25(22)29)26-9-10-27-32-28(13-16-34(26,27)3)33(2)15-12-24(37)18-23(33)19-30(32)38/h4-7,20-21,23-24,26-28,32,36-37H,8-19H2,1-3H3,(H,35,39)/t21-,23+,24-,26-,27+,28+,32+,33+,34-/m1/s1 |
| InChIKey | PICUIBGJEPCOIT-NRFQOXCRSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-oxotyraminolithocholic acid (CHEBI:232249) is a organic molecular entity (CHEBI:50860) |