SpectraBase Spectrum ID |
I1SbGHaMFXh |
Name |
(E)-3-[(1R,4aR,4bS,8aS,10aR)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthren-1-yl]-2-propenoic acid methyl ester |
CAS Registry Number |
87953-41-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H36O2 |
InChI |
InChI=1S/C23H36O2/c1-16-8-10-19-22(4,17(16)9-11-20(24)25-6)15-12-18-21(2,3)13-7-14-23(18,19)5/h8-9,11,17-19H,7,10,12-15H2,1-6H3/b11-9+/t17-,18+,19+,22+,23+/m1/s1 |
InChIKey |
QUXCIWOTUASNIL-NBPJPYDCSA-N |
Molecular Weight |
344.539 g/mol |
SMILES |
[C@]12([C@@]([C@]3(CCCC([C@@]3(CC2)[H])(C)C)C)(CC=C([C@]1(\C=C\C(=O)OC)[H])C)[H])C |
SPLASH |
splash10-002f-0901000000-c73d0b8616592aafe9d3 |
Source of Spectrum |
J-49-332-0 |
Synonyms |
(E)-3-[(1R,4aR,4bS,8aS,10aR)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthren-1-yl]acrylic acid methyl ester
Methyl (E)-3-[(1R,4aR,4bS,8aS,10aR)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthren-1-yl]prop-2-enoate |
Wiley ID |
1338349 |