| SpectraBase Compound ID | K1Qk75g6bR3 |
|---|---|
| InChI | InChI=1S/C35H54O2/c1-21(2)24-18-25-26(19-31-32(4,5)14-10-15-35(31,9)29(25)20-30(24)36)27-12-11-22(3)28-17-23(33(6,7)37)13-16-34(27,28)8/h18,20-21,23,26-28,31,36-37H,3,10-17,19H2,1-2,4-9H3/t23-,26+,27+,28+,31+,34+,35-/m1/s1 |
| InChIKey | QJDFWYBXQNDEJQ-RPABJFINSA-N |
| Mol Weight | 506.8 g/mol |
| Molecular Formula | C35H54O2 |
| Exact Mass | 506.412381 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GDsBz6mdmiB |
|---|---|
| Name | Ferrugieudesmol |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H54O2 |
| InChI | InChI=1S/C35H54O2/c1-21(2)24-18-25-26(19-31-32(4,5)14-10-15-35(31,9)29(25)20-30(24)36)27-12-11-22(3)28-17-23(33(6,7)37)13-16-34(27,28)8/h18,20-21,23,26-28,31,36-37H,3,10-17,19H2,1-2,4-9H3/t23-,26+,27+,28+,31+,34+,35-/m1/s1 |
| InChIKey | QJDFWYBXQNDEJQ-RPABJFINSA-N |
| Molecular Weight | 506.815 g/mol |
| SMILES | OC([C@]1(C[C@@]2([C@]([C@]([C@]3(C[C@@]4([C@@](c5c3cc(c(c5)O)C(C)C)(CCCC4(C)C)C)[H])[H])(CCC2=C)[H])(CC1)C)[H])[H])(C)C |
| SPLASH | splash10-000i-0190000000-53ddfe78650d1b14c377 |
| Source of Spectrum | G4-69-1613-2 |
| Synonyms | (4bS,8aS,10R)-10-[(1S,4aS,6R,8aS)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylene-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-yl]-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-3-ol (4bS,8aS,10R)-10-[(1S,4aS,6R,8aS)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-yl]-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-3-ol (4bS,8aS,10R)-10-[(1S,4aS,6R,8aS)-8a-methyl-4-methylidene-6-(2-oxidanylpropan-2-yl)-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-yl]-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-3-ol |
| Wiley ID | 1694504 |