| SpectraBase Spectrum ID |
GxI1qhrMYBz |
| Name |
5.alpha.-Cholestan-19-oic acid, 2.alpha.-methoxy- |
| CAS Registry Number |
28809-61-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H48O3 |
| InChI |
InChI=1S/C28H48O3/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20-9-11-21(31-5)17-28(20,26(29)30)25(22)15-16-27(23,24)4/h18-25H,6-17H2,1-5H3,(H,29,30)/t19-,20-,21+,22+,23-,24+,25+,27-,28-/m1/s1 |
| InChIKey |
LVDPLXKYSNFYLU-PMAMDFEJSA-N |
| Molecular Weight |
432.689 g/mol |
| SMILES |
OC([C@]12[C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@]2(CC[C@@](C1)(OC)[H])[H])[H])=O |
| SPLASH |
splash10-001r-0007900000-a224e1662ba918a682ab |
| Source of Spectrum |
O-4-379-12 |
| Synonyms |
(2alpha,5alpha)-2-methoxycholestan-19-oic acid
2.alpha.-methoxy-19-carboxy-5.alpha.-cholestane |
| Wiley ID |
1382499 |
