SpectraBase Spectrum ID |
Chmfc9qSWON |
Name |
Pregn-5-en-3-ol, 20-methyl-21-[2-methyl-3-(1-methylethyl)-2-cyclopropen-1-yl]-, [3.beta.,20R,21(R)]- |
CAS Registry Number |
83511-84-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H46O |
InChI |
InChI=1S/C29H46O/c1-17(2)27-19(4)23(27)15-18(3)24-9-10-25-22-8-7-20-16-21(30)11-13-28(20,5)26(22)12-14-29(24,25)6/h7,17-18,21-26,30H,8-16H2,1-6H3/t18-,21+,22+,23?,24-,25+,26+,28+,29-/m1/s1 |
InChIKey |
HBUXJBGKOKXRBP-NEOAVWEOSA-N |
Molecular Weight |
410.686 g/mol |
SMILES |
O[C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@@]([C@@](CC5C(=C5C(C)C)C)(C)[H])(CC[C@]4([C@@]3(CC=C2C1)[H])[H])[H])C)[H])C)[H] |
SPLASH |
splash10-0592-8941000000-cb4ed0afcce8c5f4b018 |
Source of Spectrum |
SD-1992-0-0 |
Synonyms |
(1S,2R,5S,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R)-1-[2-methyl-3-(propan-2-yl)cycloprop-2-en-1-yl]propan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol
(23R)-23,28-cyclostigmasta-5,24(28)-dien-3-.beta.-ol
(23R)-23H-Isocalysterol
(23S)-23H-Isocalysterol
Isocalysterol |
Wiley ID |
1373912 |