| SpectraBase Spectrum ID |
Ef5ymLTP9hp |
| Name |
4a(2H)-Picenecarboxylic acid, 1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydro-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl- |
| Copyright |
Copyright © 2020-2024 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-IGLZOKRPSA-N |
| Molecular Weight |
456.711 g/mol |
| SMILES |
OC1CC[C@]2([C@@](CC[C@]3([C@]4(C(C5C(C(=O)O)(CC4)CC[C@](C5C)(C)[H])=CC[C@]23[H])C)C)(C1(C)C)[H])C |
| SPLASH |
splash10-0aou-9710000000-7206de6f9e2ea5009ff2 |
| Source of Spectrum |
IY-1-4699-7 |
| Synonyms |
(2R,6aR,6aS,6bR,8aR,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 |
1654980 |
