| SpectraBase Compound ID | 7XcFfAZc4q0 |
|---|---|
| InChI | InChI=1S/C32H52O2/c1-20(2)26(21(3)4)11-9-22(5)28-13-14-29-27-12-10-24-19-25(34-23(6)33)15-17-31(24,7)30(27)16-18-32(28,29)8/h9-11,20-22,25-30H,12-19H2,1-8H3/b11-9-/t22-,25+,27+,28-,29+,30+,31+,32-/m1/s1 |
| InChIKey | UYBPFLLYAWQBDC-LMQAKJRXSA-N |
| Mol Weight | 468.8 g/mol |
| Molecular Formula | C32H52O2 |
| Exact Mass | 468.396731 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | H9X3biJcoRN |
|---|---|
| Name | 24-Isopropylcholesta-5,22(Z)-dien-3.beta.-ol - Acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H52O2 |
| InChI | InChI=1S/C32H52O2/c1-20(2)26(21(3)4)11-9-22(5)28-13-14-29-27-12-10-24-19-25(34-23(6)33)15-17-31(24,7)30(27)16-18-32(28,29)8/h9-11,20-22,25-30H,12-19H2,1-8H3/b11-9-/t22-,25+,27+,28-,29+,30+,31+,32-/m1/s1 |
| InChIKey | UYBPFLLYAWQBDC-LMQAKJRXSA-N |
| Molecular Weight | 468.766 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])(CC[C@@]1([C@@](\C=C/C(C(C)C)C(C)C)(C)[H])[H])[H])C |
| SPLASH | splash10-0a4i-0085900000-510b3aa06fe7b26e0e42 |
| Source of Spectrum | X4-21-222-0 |
| Synonyms | (1S,2R,5S,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R,3Z)-6-methyl-5-(propan-2-yl)hept-3-en-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-yl acetate Acetic acid [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-ylhept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-ylhept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,8S,9S,10R,13R,14S,17R)-17-[(Z,1R)-4-isopropyl-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-yl-hept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 1585831 |