| SpectraBase Spectrum ID |
BnOWj00fnu1 |
| Name |
(22E,24R)-24-Methyl-19-norcholesta-1,3,5(10),22-tetraen-3-ol |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H40O |
| InChI |
InChI=1S/C27H40O/c1-17(2)18(3)6-7-19(4)25-12-13-26-24-10-8-20-16-21(28)9-11-22(20)23(24)14-15-27(25,26)5/h6-7,9,11,16-19,23-26,28H,8,10,12-15H2,1-5H3/b7-6+/t18-,19+,23+,24+,25+,26-,27+/m0/s1 |
| InChIKey |
NXXMTWFZPIADGB-DVQRTUCZSA-N |
| Instrument Name |
Finnigan-MAT-95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np100562n |
| Molecular Weight |
380.616 g/mol |
| Optical Rotation |
[a]D24 = +63 (c = 0.01, CHCl3) |
| Reported Formula |
C27H40O |
| SMILES |
Oc1cc2CC[C@]3([C@@]4(CC[C@]([H])([C@](C)(\C=C\[C@](C)(C(C)C)[H])[H])[C@@]4(C)CC[C@]3([H])c2cc1)[H])[H] |
| SPLASH |
splash10-053r-4956000000-1a6b9bf8e5f04da01c05 |
| Source of Spectrum |
G4-74-179-7 |
| Wiley ID |
1849039 |
