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CHEBI:136903 - hyodeoxycholic acid 24-O-(β-D-glucuronide)(1−)
| Formula | C30H47O10 |
| Net Charge | -1 |
| Average Mass | 567.696 |
| Monoisotopic Mass | 567.31747 |
| SMILES | [H][C@@]12C[C@H](O)[C@]3([H])C[C@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CCC(=O)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O |
| InChI | InChI=1S/C30H48O10/c1-14(4-7-22(33)39-28-25(36)23(34)24(35)26(40-28)27(37)38)17-5-6-18-16-13-21(32)20-12-15(31)8-10-30(20,3)19(16)9-11-29(17,18)2/h14-21,23-26,28,31-32,34-36H,4-13H2,1-3H3,(H,37,38)/p-1/t14-,15-,16+,17-,18+,19+,20+,21+,23+,24+,25-,26+,28-,29-,30-/m1/s1 |
| InChIKey | GSKDKHGYQRRKMF-HHUAQUJWSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| hyodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136903) is a monocarboxylic acid anion (CHEBI:35757) |
| hyodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136903) is a steroid glucosiduronic acid anion (CHEBI:136637) |
| hyodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136903) is a β-D-glucosiduronate (CHEBI:83411) |
| hyodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136903) is conjugate base of hyodeoxycholic acid 24-O-(β-D-glucuronide) (CHEBI:137812) |
| Incoming Relation(s) |
| hyodeoxycholic acid 24-O-(β-D-glucuronide) (CHEBI:137812) is conjugate acid of hyodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136903) |
| IUPAC Name |
|---|
| 1-O-(3α,6α-dihydroxy-24-oxo-5β-cholan-24-yl)-β-D-glucopyranuronate |
| Synonyms | Source |
|---|---|
| HDCA-24G(1−) | SUBMITTER |
| 1-O-[(3α,5β,6α)-3,6-dihydroxy-24-oxocholan-24-yl]-β-D-glucopyranuronate | IUPAC |
| UniProt Name | Source |
|---|---|
| hyodeoxycholoyl-24-O-(β-D-glucuronate) | UniProt |
| Citations |
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