| SpectraBase Spectrum ID |
LnM66VYm2fT |
| Name |
(3aS,5aR,10cR)-7-((S)-Methoxy)-10b-(S)-methyl-3a-methyl-1,2,3,3a,5a,7,10b,10c-octahydro-5,8-dioxa-acephenanthrylene-4,9-dione |
| Appearance |
Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20O5 |
| InChI |
InChI=1S/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3/t11-,13-,14+,16-,17+/m1/s1 |
| InChIKey |
XFWZBMTTXLUWKW-YIUHCBHRSA-N |
| Instrument Name |
MAT-312 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np020144m |
| Molecular Weight |
304.342 g/mol |
| Optical Rotation |
[a]D23 = -191.2 (c = 0.21, CHCl3); |
| SMILES |
C1C[C@]2(C)C(=O)O[C@]3([C@]2([H])[C@@](C)(C2=CC(=O)O[C@](OC)(C2=C3)[H])C1)[H] |
| SPLASH |
splash10-006x-0491000000-36274ea1837c4ac3a4f2 |
| Source of Spectrum |
G4-66-SM2-2 |
| Wiley ID |
1881203 |
