SpectraBase Spectrum ID |
7GAV29WfclK |
Name |
(1S,4R,5R,7S,8R,9S,10S)-7,8,9-Triacetyloxy-1-deuteriouruap-3(12)-ene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H29DO6 |
InChI |
InChI=1S/C21H30O6/c1-10-8-14-9-21(7)15(10)16(14)20(5,6)18(26-12(3)23)17(25-11(2)22)19(21)27-13(4)24/h14-19H,1,8-9H2,2-7H3/t14-,15-,16+,17-,18+,19+,21-/m0/s1/i14D |
InChIKey |
UUGAASCOWHNKOT-RWMMACMTSA-N |
Instrument Name |
Hewlett-Packard 5989A or Hewlett Packard 5989B or Saturn 2000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/np0201570 |
Molecular Weight |
379.471 g/mol |
SMILES |
[C@@]12([C@]3([C@](C[C@@]1([C@@]([C@]([C@](C3(C)C)(OC(C)=O)[H])(OC(C)=O)[H])(OC(C)=O)[H])C)(CC2=C)[D])[H])[H] |
SPLASH |
splash10-066u-5690000000-04dd36dbf83395ec809f |
Source of Spectrum |
G4-65-1545-20 |
Wiley ID |
1883478 |