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CHEBI:215368 - Beta-pisosterol
| Formula | C33H54O4 |
| Net Charge | 0 |
| Average Mass | 514.791 |
| Monoisotopic Mass | 514.40221 |
| SMILES | C=C(C(C)C)[C@H](O)[C@H](OC(C)=O)[C@@H](C)[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/C33H54O4/c1-19(2)20(3)28(36)29(37-22(5)34)21(4)23-13-17-33(10)25-11-12-26-30(6,7)27(35)15-16-31(26,8)24(25)14-18-32(23,33)9/h19,21,23,26-29,35-36H,3,11-18H2,1-2,4-10H3/t21-,23+,26-,27+,28-,29+,31+,32+,33-/m0/s1 |
| InChIKey | FCOMGKKGSLAJCY-LVCRVOBGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Pisolithus tinctorius (ncbitaxon:37468) | - | DOI (10.1590/s0103-50532005000500028) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Beta-pisosterol (CHEBI:215368) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| [(2S,3R,4S)-4-hydroxy-2-[(3R,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]-6-methyl-5-methylideneheptan-3-yl] acetate |
| Manual Xrefs | Databases |
|---|---|
| 78441913 | ChemSpider |