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CHEBI:203597 - 3beta-Linoleyloxyergosta-7,24(28)-diene
| Formula | C46H76O2 |
| Net Charge | 0 |
| Average Mass | 661.112 |
| Monoisotopic Mass | 660.58453 |
| SMILES | C=C(CC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](OC(=O)CCCCCCC/C=C\C/C=C\CCCCC)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C |
| InChI | InChI=1S/C46H76O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-44(47)48-39-30-32-45(6)38(34-39)26-27-40-42-29-28-41(46(42,7)33-31-43(40)45)37(5)25-24-36(4)35(2)3/h12-13,15-16,27,35,37-39,41-43H,4,8-11,14,17-26,28-34H2,1-3,5-7H3/b13-12-,16-15-/t37-,38+,39+,41-,42+,43+,45+,46-/m1/s1 |
| InChIKey | CGPXQZWXSOOFBC-OQAFIIOUSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Fomitopsis pinicola (ncbitaxon:40483) | - | DOI (10.1016/s0031-9422(00)00165-5) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3beta-Linoleyloxyergosta-7,24(28)-diene (CHEBI:203597) is a steroid ester (CHEBI:47880) |
| IUPAC Name |
|---|
| [(3S,5S,9R,10S,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (9Z,12Z)-octadeca-9,12-dienoate |
| Manual Xrefs | Databases |
|---|---|
| 78442574 | ChemSpider |