SpectraBase Spectrum ID |
1rf98fQIZGC |
Name |
1-Naphthalenecarboxylic acid, 5-[5-(acetyloxy)-3-methyl-3-pentenyl]decahydro-1,4a-dimethyl-6-methyl ene-, methyl ester, [1S-[1.alpha.,4a.alpha.,5.alpha.(E),8a.beta.]]- |
CAS Registry Number |
1909-96-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H36O4 |
InChI |
InChI=1S/C23H36O4/c1-16(12-15-27-18(3)24)8-10-19-17(2)9-11-20-22(19,4)13-7-14-23(20,5)21(25)26-6/h12,19-20H,2,7-11,13-15H2,1,3-6H3/b16-12+/t19-,20+,22+,23-/m0/s1 |
InChIKey |
AORYFYLFZDBOMS-AKEOPSGXSA-N |
Molecular Weight |
376.537 g/mol |
SMILES |
[C@@]12([C@]([C@](C(=O)OC)(C)CCC2)(CCC([C@@]1(CC\C(=C\COC(=O)C)C)[H])=C)[H])C |
SPLASH |
splash10-0awl-0920000000-376669eae2c81e4fbc6a |
Source of Spectrum |
B-34-1078-0 |
Synonyms |
Labda-8(20),13-dien-19-oic acid, 15-hydroxy-, methyl ester, acetate, trans-
Methyl (1S,4aR,5S,8aR)-5-[(3E)-5-(acetyloxy)-3-methyl-3-pentenyl]-1,4a-dimethyl-6-methylenedecahydro-1-naphthalenecarboxylate
Methylester of (E)-15-acetoxylabda-8(17),13-dien-19-oic acid |
Wiley ID |
1357961 |