Methyl (1S,2S,6S)-2-[2-[(1S,4aR,6S,8aR)-decahydro-6-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]ethyl]-1,3-dimethyl-6-(1-methylethenyl)-3-cyclohexene-1-propanoate
CAS Registry Number®
87453-36-9
CAS Name
Methyl (1S,2S,6S)-2-[2-[(1S,4aR,6S,8aR)-decahydro-6-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]ethyl]-1,3-dimethyl-6-(1-methylethenyl)-3-cyclohexene-1-propanoateMolecular Formula
C31H50O3Molecular Mass
470.73Cite this Page
Methyl (1S,2S,6S)-2-[2-[(1S,4aR,6S,8aR)-decahydro-6-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]ethyl]-1,3-dimethyl-6-(1-methylethenyl)-3-cyclohexene-1-propanoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=87453-36-9 (retrieved ) (CAS RN: 87453-36-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C31H50O3/c1-20(2)23-12-10-21(3)24(30(23,7)19-17-28(33)34-9)13-14-25-22(4)11-15-26-29(5,6)27(32)16-18-31(25,26)8/h10,23-27,32H,1,4,11-19H2,2-3,5-9H3/t23-,24-,25-,26-,27-,30-,31+/m0/s1
InChIKey
InChIKey=UCRMFRXIRGKEPT-NGVCODNXSA-N
SMILES
C[C@@]12[C@](C(C)(C)[C@@H](O)CC1)(CCC(=C)[C@@H]2CC[C@@H]3[C@](CCC(OC)=O)(C)[C@H](C(C)=C)CC=C3C)[H]
Canonical SMILES
O=C(OC)CCC1(C)C(C(=C)C)CC=C(C)C1CCC2C(=C)CCC3C(C)(C)C(O)CCC23C
Other Names for this Substance
- 3-Cyclohexene-1-propanoic acid, 2-[2-[(1S,4aR,6S,8aR)-decahydro-6-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]ethyl]-1,3-dimethyl-6-(1-methylethenyl)-, methyl ester, (1S,2S,6S)-
- 3-Cyclohexene-1-propanoic acid, 2-[2-(decahydro-6-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl)ethyl]-1,3-dimethyl-6-(1-methylethenyl)-, methyl ester, [1S-[1α(1R*,2R*,6R*),4aβ,6α,8aα]]-
- Methyl (1S,2S,6S)-2-[2-[(1S,4aR,6S,8aR)-decahydro-6-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]ethyl]-1,3-dimethyl-6-(1-methylethenyl)-3-cyclohexene-1-propanoate
