| SpectraBase Spectrum ID |
IqAv8AffVvN |
| Name |
(1S,2R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxidanylidene-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Alternate Name(s) |
(1S,2R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
(1S,2R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-10-keto-1,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H46O3 |
| InChI |
InChI=1S/C30H46O3/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/h8,18-19,21-22,24H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,24+,27+,28-,29-,30+/m1/s1 |
| InChIKey |
MUCRYNWJQNHDJH-OADIDDRXSA-N |
| Molecular Weight |
454.695 g/mol |
| SMILES |
OC([C@]12[C@](C=3[C@]([C@@]4(CC[C@@]5([C@@]([C@]4(CC3)[H])(CCC(=O)C5(C)C)C)[H])C)(CC1)C)([C@]([C@@](CC2)(C)[H])(C)[H])[H])=O |
| SPLASH |
splash10-0a59-5940000000-bfdfd0824c76a759a54d |
| Source of Spectrum |
PS-0-0-13 |
| Wiley ID |
851088 |
