SpectraBase Spectrum ID |
Ew3n7OsRxzp |
Name |
Tricycloalterfurene C |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H32O6 |
InChI |
InChI=1S/C21H32O6/c1-12(5-8-17(24)20(2,3)25)9-13-11-21(4)18(26-13)10-14-15(22)6-7-16(23)19(14)27-21/h9,13,16-18,23-25H,5-8,10-11H2,1-4H3/b12-9+/t13-,16-,17?,18+,21+/m0/s1 |
InChIKey |
FWXCOKASJBNAHR-MKZAAYLKSA-N |
Instrument Name |
Autospec Premier P776 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.jnatprod.7b00478 |
Molecular Weight |
380.481 g/mol |
Optical Rotation |
[a]D19 = +110 (c = 0.07, MeOH) |
Reported Formula |
C21H32O6 |
SMILES |
O[C@]1(CCC(C2=C1O[C@]1([C@](O[C@@](\C=C\(CCC(C(C)(C)O)O)C)(C1)[H])(C2)[H])C)=O)[H] |
SPLASH |
splash10-002b-2912000000-9cf2b82cf701b18cb6db |
Source of Spectrum |
G4-80-2528-4 |
Wiley ID |
1867633 |