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CHEBI:206746 - 5a,8a-Epidioxyergosta-6,9(11),22-trien-3
| Formula | C28H42O3 |
| Net Charge | 0 |
| Average Mass | 426.641 |
| Monoisotopic Mass | 426.31340 |
| SMILES | CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@]1(C)CC=C1[C@]23C=C[C@]2(C[C@@H](O)CC[C@]12C)OO3 |
| InChI | InChI=1S/C28H42O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,12,15-16,18-23,29H,9-11,13-14,17H2,1-6H3/b8-7+/t19-,20+,21-,22+,23+,25+,26+,27+,28-/m0/s1 |
| InChIKey | FWPYIYVSYQRISA-LEOBWYFPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma amboinense (ncbitaxon:2952274) | - | DOI (10.1016/0031-9422(93)85177-s) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5a,8a-Epidioxyergosta-6,9(11),22-trien-3 (CHEBI:206746) is a ergostanoid (CHEBI:50403) |
| IUPAC Name |
|---|
| (1S,2R,5R,6R,10R,13S,15S)-5-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadeca-8,18-dien-13-ol |
| Manual Xrefs | Databases |
|---|---|
| 9287871 | ChemSpider |