SpectraBase Spectrum ID |
Gga0ycE8Rdp |
Name |
(1S,2R,4aS,6aS,6bR,12aR)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H48O3 |
InChI |
InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21?,22?,23?,24?,27+,28-,29-,30+/m1/s1 |
InChIKey |
WCGUUGGRBIKTOS-MSSRRZPQSA-N |
Molecular Weight |
456.711 g/mol |
SMILES |
OC1CC[C@]2(C(CC[C@]3([C@]4(C(C5[C@@](C(=O)O)(CC4)CC[C@]([C@@]5(C)[H])(C)[H])=CCC23)C)C)C1(C)C)C |
SPLASH |
splash10-00di-6920000000-00fad3c92428e6c6dc94 |
Source of Spectrum |
PS-1999-0-88 |
Synonyms |
(1S,2R,4aS,6aS,6bR,12aR)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid |
Wiley ID |
1389505 |