| SpectraBase Spectrum ID |
IbYp9sWyXXq |
| Name |
(2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-11-keto-2,4a,6a,6a,9,14a-hexamethyl-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid |
| CAS Registry Number |
34157-83-0 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H38O4 |
| InChI |
InChI=1S/C29H38O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h7-8,15,22,31H,9-14,16H2,1-6H3,(H,32,33)/t22-,25-,26-,27+,28-,29+/m1/s1 |
| InChIKey |
KQJSQWZMSAGSHN-JJWQIEBTSA-N |
| Molecular Weight |
450.619 g/mol |
| SMILES |
OC1=C(C=2C([C@@]3(CC[C@]4([C@]5([C@](CC[C@@](C(=O)O)(C5)C)(CC[C@@]4(C3=CC2)C)C)[H])C)C)=CC1=O)C |
| SPLASH |
splash10-0uxr-0190000000-dfa0bf4e2b590981c827 |
| Source of Spectrum |
X2-57-6-3 |
| Synonyms |
(2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid
(2R,4aS,6aR,6aS,14aS,14bR)-2,4a,6a,6a,9,14a-hexamethyl-10-oxidanyl-11-oxidanylidene-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid
Celastrol
D:a-friedo-24-noroleana-1(10),3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo-, (20alpha)-
Tripterine |
| Wiley ID |
1605322 |
