| SpectraBase Spectrum ID |
8HlQwY0KUYQ |
| Name |
(4R,4aS,6aS,6aS,6bR,8aR,11R,12aS,14aS,14bS)-4,4a,6a,6b,11,14a-hexamethyl-8a,11-dimethylol-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one |
| Alternate Name(s) |
(4R,4aS,6aS,6aS,6bR,8aR,11R,12aS,14aS,14bS)-8a,11-bis(hydroxymethyl)-4,4a,6a,6b,11,14a-hexamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one |
| CAS Registry Number |
83692-08-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50O3 |
| InChI |
InChI=1S/C30H50O3/c1-20-21(33)7-8-22-26(20,3)10-9-23-27(22,4)12-13-29(6)24-17-25(2,18-31)11-15-30(24,19-32)16-14-28(23,29)5/h20,22-24,31-32H,7-19H2,1-6H3/t20-,22+,23-,24-,25+,26+,27-,28+,29-,30+/m0/s1 |
| InChIKey |
ZMSNKXDPESNSSS-CUKXIHTOSA-N |
| Molecular Weight |
458.727 g/mol |
| SMILES |
OC[C@]1(C[C@]2([C@]3([C@](CC[C@@]2(CO)CC1)([C@@]1([C@@](CC3)([C@@]2(CCC([C@@]([C@]2(CC1)C)(C)[H])=O)[H])C)[H])C)C)[H])C |
| SPLASH |
splash10-05di-0420900000-def6ec884c2fe8934ee1 |
| Source of Spectrum |
X2-53-1040-3 |
| Wiley ID |
1603668 |
