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CHEBI:212608 - Inoterpene B
| Formula | C30H52O3 |
| Net Charge | 0 |
| Average Mass | 460.743 |
| Monoisotopic Mass | 460.39165 |
| SMILES | C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3 |
| InChI | InChI=1S/C30H52O3/c1-19(9-12-25(32)27(4,5)33)20-13-17-30(8)22-10-11-23-26(2,3)24(31)15-16-28(23,6)21(22)14-18-29(20,30)7/h19-20,23-25,31-33H,9-18H2,1-8H3/t19-,20-,23+,24+,25-,28-,29-,30+/m1/s1 |
| InChIKey | JFEXJRXYTKYHOD-IFNSRKHFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Inonotus obliquus (ncbitaxon:167356) | - | DOI (10.1016/j.tet.2009.01.076) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Inoterpene B (CHEBI:212608) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (3R,6R)-6-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptane-2,3-diol |
| Manual Xrefs | Databases |
|---|---|
| 78437469 | ChemSpider |