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CHEBI:210683 - 22E,24R-ergosta-7,22-diene-3beta,5beta,6alpha-triol
| Formula | C28H46O3 |
| Net Charge | 0 |
| Average Mass | 430.673 |
| Monoisotopic Mass | 430.34470 |
| SMILES | CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=C[C@H](O)[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |
| InChI | InChI=1S/C28H46O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,22+,23-,24-,25-,26+,27+,28+/m0/s1 |
| InChIKey | ARXHRTZAVQOQEU-WQBKXUAISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Catathelasma imperiale (ncbitaxon:181976) | - | DOI (10.1002/cjoc.20030211031) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 22E,24R-ergosta-7,22-diene-3beta,5beta,6alpha-triol (CHEBI:210683) is a ergostanoid (CHEBI:50403) |
| IUPAC Name |
|---|
| (3S,5S,6S,9S,10R,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol |
| Manual Xrefs | Databases |
|---|---|
| 78442765 | ChemSpider |