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CHEBI:217564 - Stereinone I
| Formula | C32H54O5 |
| Net Charge | 0 |
| Average Mass | 518.779 |
| Monoisotopic Mass | 518.39712 |
| SMILES | CC(=O)O[C@H]1CC[C@]2(C)C3=C(CC[C@H]2C1(C)C)[C@]1(C)CC[C@H]([C@H](C)CC[C@H](O)C(C)(C)O)[C@@]1(C)[C@H](O)C3 |
| InChI | InChI=1S/C32H54O5/c1-19(10-13-25(34)29(5,6)36)21-14-17-31(8)22-11-12-24-28(3,4)27(37-20(2)33)15-16-30(24,7)23(22)18-26(35)32(21,31)9/h19,21,24-27,34-36H,10-18H2,1-9H3/t19-,21-,24+,25+,26-,27+,30-,31+,32+/m1/s1 |
| InChIKey | VONUTBNGQSASQX-JVXVSLEUSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Stereumspecies (ncbitaxon:1849817) | - | PubMed (29197540) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Stereinone I (CHEBI:217564) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| [(3S,5R,10S,12R,13R,14S,17R)-17-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-12-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate |