| SpectraBase Spectrum ID |
H9T582csR8z |
| Name |
Chola-5,16-diene-3,20,24-triol, 3,24-diacetate, (3.beta.,20R)- |
| CAS Registry Number |
115320-76-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H42O5 |
| InChI |
InChI=1S/C28H42O5/c1-18(29)32-16-6-13-28(5,31)25-10-9-23-22-8-7-20-17-21(33-19(2)30)11-14-26(20,3)24(22)12-15-27(23,25)4/h7,10,21-24,31H,6,8-9,11-17H2,1-5H3/t21-,22?,23?,24?,26?,27?,28+/m0/s1 |
| InChIKey |
WZVCJTLIDVXLKT-AWQKPQNXSA-N |
| Molecular Weight |
458.639 g/mol |
| SMILES |
O[C@@](C=1C2(C(C3CC=C4C(C3CC2)(CC[C@](OC(=O)C)(C4)[H])C)CC1)C)(CCCOC(=O)C)C |
| SPLASH |
splash10-052s-9384000000-50392625a0cd6bfb0660 |
| Source of Spectrum |
J-53-3472-9 |
| Synonyms |
(20R)-3.beta.,20-dihydroxy-16-(1-methyl-1-hydroxy-4-hydroxy-butyl)-5,10-choladiene
(3beta,20R)-24-(acetyloxy)-20-hydroxychola-5,16-dien-3-yl acetate |
| Wiley ID |
1389977 |
