| SpectraBase Compound ID | EJ5yU2EpAeM |
|---|---|
| InChI | InChI=1S/C29H48O/c1-7-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10,20-21,23-27,30H,8-9,11-18H2,1-6H3/b19-7+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1 |
| InChIKey | MMFZLVUIFVOBLE-NXCJKEPKSA-N |
| Mol Weight | 412.7 g/mol |
| Molecular Formula | C29H48O |
| Exact Mass | 412.370516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | H88jSbvRYOl |
|---|---|
| Name | (24S,25(26)e)-24,26-dimethylcholesta-5,25(26)-dien-3.beta.-ol |
| CAS Registry Number | 71477-08-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48O |
| InChI | InChI=1S/C29H48O/c1-7-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10,20-21,23-27,30H,8-9,11-18H2,1-6H3/b19-7+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1 |
| InChIKey | MMFZLVUIFVOBLE-NXCJKEPKSA-N |
| Molecular Weight | 412.702 g/mol |
| SMILES | O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](CC[C@](\C(=C\C)C)(C)[H])(C)[H])[H])[H])C)[H])C)[H] |
| SPLASH | splash10-03e9-5096600000-7eaa1a2d3fa158733133 |
| Source of Spectrum | J-52-4521-26 |
| Synonyms | (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,1R,4R)-1,4,5-trimethylhept-5-enyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol (24R,25(26)e)-24,26-dimethylcholesta-5,25(26)-dien-3.beta.-ol 27-Norergost-5-en-3-ol, 25-ethylidene-, (3.beta.,24R,25E)- (3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5R)-5,6-dimethyloct-6-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Wiley ID | 1374793 |