| SpectraBase Spectrum ID |
L5GTJs7tQay |
| Name |
5.alpha.-Acetoxy-8-angeloyloxy-2.beta.,3.beta.-epoxybisabola-7(14),10(11)-dien-4-one |
| Appearance |
Colorless gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H30O6 |
| InChI |
InChI=1S/C22H30O6/c1-8-13(4)21(25)27-17(10-9-12(2)3)14(5)16-11-18-22(7,28-18)20(24)19(16)26-15(6)23/h8-9,16-19H,5,10-11H2,1-4,6-7H3/b13-8-/t16-,17?,18-,19-,22-/m0/s1 |
| InChIKey |
DAQJZMZCFFUHCO-NAFQNHHTSA-N |
| Instrument Name |
HP5989A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900489h |
| Molecular Weight |
390.476 g/mol |
| Optical Rotation |
[a]D22 = -26.3 (c = 0.5, MeOH) |
| Reported Formula |
C22H30O6 |
| SMILES |
[C@]12(C[C@]([C@@](C([C@]2(O1)C)=O)(OC(=O)C)[H])(C(=C)C(OC(\C(C)=C/C)=O)CC=C(C)C)[H])[H] |
| SPLASH |
splash10-0002-9000000000-fc9ad20b026dc4f896b7 |
| Source of Spectrum |
G4-73-142-3 |
| Wiley ID |
1846406 |
