| SpectraBase Spectrum ID |
5vO9O0bUFQi |
| Name |
(4aS,4bR,6aS,12aS,12bR,14aS)-10-methoxy-1,1,4a,6a,12b-pentamethyl-2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tetradecahydro-1H-naphtho[2,1-a]xanthene |
| Appearance |
Colorless amorphous |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H40O2 |
| InChI |
InChI=1S/C27H40O2/c1-24(2)12-7-13-25(3)21(24)10-14-26(4)22(25)11-15-27(5)23(26)17-18-16-19(28-6)8-9-20(18)29-27/h8-9,16,21-23H,7,10-15,17H2,1-6H3/t21-,22+,23-,25-,26+,27-/m0/s1 |
| InChIKey |
GKUDWHZWZSLTOY-UXVOVBSOSA-N |
| Instrument Name |
Thermo Quest TSQ 700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030312q |
| Molecular Weight |
396.615 g/mol |
| Optical Rotation |
[a]D26 = -71.9 (c = 1.1, CHCl3) |
| Quality |
39 |
| Reported Formula |
C27H40O2 |
| SMILES |
C1C[C@]2([C@](C(C1)(C)C)(CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC1=C(O2)C=CC(=C1)OC)[H])C)[H])C)[H])C |
| SPLASH |
splash10-0002-0119000000-04bbfc17b6e564e3c0d9 |
| Source of Spectrum |
G4-66-1603-5 (DOI: 10.1021/np030312q) |
| Wiley ID |
1892583 |
![(4aS,4bR,6aS,12aS,12bR,14aS)-10-methoxy-1,1,4a,6a,12b-pentamethyl-2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tetradecahydro-1H-naphtho[2,1-a]xanthene](/api/spectrum/5vO9O0bUFQi/structure.png?h=300&w=458 "(4aS,4bR,6aS,12aS,12bR,14aS)-10-methoxy-1,1,4a,6a,12b-pentamethyl-2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tetradecahydro-1H-naphtho[2,1-a]xanthene")
