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CHEBI:196608 - 7alpha,12alpha-Dihydroxy-5beta-chol-2-en-24-oic Acid
| Formula | C24H38O4 |
| Net Charge | 0 |
| Average Mass | 390.564 |
| Monoisotopic Mass | 390.27701 |
| SMILES | [H][C@@]12CC=CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CCC(=O)O)[C@]1([H])[C@H](O)C2 |
| InChI | InChI=1S/C24H38O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h4-5,14-20,22,25-26H,6-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1 |
| InChIKey | KHTQKVWLBDPPPW-QLEQUTGBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7alpha,12alpha-Dihydroxy-5beta-chol-2-en-24-oic Acid (CHEBI:196608) is a cholanoid (CHEBI:36078) |
| IUPAC Name |
|---|
| (4R)-4-[(5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid |
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|---|---|
| LMST04010395 | LIPID MAPS |
| 4447227 | ChemSpider |