| SpectraBase Spectrum ID |
3obZ1GnTGK |
| Name |
25-Hydroxy-24-epicastasterone |
| Alternate Name(s) |
(2alpha,3alpha,22R,23R)-2,3,22,23,25-pentahydroxyergostan-6-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H48O6 |
| InChI |
InChI=1S/C28H48O6/c1-14(24(32)25(33)15(2)26(3,4)34)17-7-8-18-16-11-21(29)20-12-22(30)23(31)13-28(20,6)19(16)9-10-27(17,18)5/h14-20,22-25,30-34H,7-13H2,1-6H3/t14-,15-,16?,17?,18?,19?,20?,22-,23+,24+,25+,27+,28+/m0/s1 |
| InChIKey |
RRJQKHFCSYXNBC-AGLSRYARSA-N |
| Molecular Weight |
480.686 g/mol |
| SMILES |
OC([C@]([C@]([C@@]([C@](C1[C@]2(CCC3C(C2CC1)CC(C1[C@@]3(C[C@]([C@@](O)(C1)[H])(O)[H])C)=O)C)(C)[H])(O)[H])(O)[H])(C)[H])(C)C |
| SPLASH |
splash10-01ot-0009000000-aca14bd4a5f70b3def57 |
| Source of Spectrum |
F-52-10657-6 |
| Wiley ID |
798140 |
