| SpectraBase Compound ID | 7sS2NDo7MC |
|---|---|
| InChI | InChI=1S/C31H52O/c1-20(2)21(3)10-11-22(4)23-14-18-31(9)25-12-13-26-28(5,6)27(32)16-17-29(26,7)24(25)15-19-30(23,31)8/h20,22-23,26-27,32H,3,10-19H2,1-2,4-9H3/t22-,23-,26-,27-,29+,30-,31+/m0/s1 |
| InChIKey | XJLZCPIILZRCPS-CKCUNPICSA-N |
| Mol Weight | 440.8 g/mol |
| Molecular Formula | C31H52O |
| Exact Mass | 440.401816 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EdBFEE0kCn5 |
|---|---|
| Name | Euphorbol |
| Alternate Name(s) | (3S,5R,10S,13S,14S,17S)-17-[(1S)-1,5-dimethyl-4-methylene-hexyl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,5R,10S,13S,14S,17S)-17-[(1S)-4-isopropyl-1-methyl-pent-4-enyl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,5R,10S,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(2S)-6-methyl-5-methyleneheptan-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,5R,10S,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(2S)-6-methyl-5-methylidene-heptan-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H52O |
| InChI | InChI=1S/C31H52O/c1-20(2)21(3)10-11-22(4)23-14-18-31(9)25-12-13-26-28(5,6)27(32)16-17-29(26,7)24(25)15-19-30(23,31)8/h20,22-23,26-27,32H,3,10-19H2,1-2,4-9H3/t22-,23-,26-,27-,29+,30-,31+/m0/s1 |
| InChIKey | XJLZCPIILZRCPS-CKCUNPICSA-N |
| Molecular Weight | 440.756 g/mol |
| SMILES | O[C@@]1(C([C@@]2(CCC=3[C@@]4([C@]([C@@]([C@](CCC(=C)C(C)C)(C)[H])([H])CC4)(CCC3[C@]2(CC1)C)C)C)[H])(C)C)[H] |
| SPLASH | splash10-056u-0410900000-b7588c0c720af680d47e |
| Source of Spectrum | G4-65-161-4 |
| Wiley ID | 1609393 |