| SpectraBase Spectrum ID |
CLrHQTsgwvR |
| Name |
1.beta.,8-Diangeloyloxy-5.alpha.-acetoxy-2.beta.,3.beta.;10,11-diepoxybisabola-7(14)-en-4-one |
| Appearance |
Colorless gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H36O9 |
| InChI |
InChI=1S/C27H36O9/c1-10-13(3)24(30)33-17(12-18-26(7,8)35-18)15(5)19-20(32-16(6)28)22(29)27(9)23(36-27)21(19)34-25(31)14(4)11-2/h10-11,17-21,23H,5,12H2,1-4,6-9H3/b13-10-,14-11-/t17?,18?,19-,20-,21-,23-,27+/m0/s1 |
| InChIKey |
VMZMBTIZKOPION-LAFIFDADSA-N |
| Instrument Name |
HP5989A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900489h |
| Molecular Weight |
504.576 g/mol |
| Optical Rotation |
[a]D22 = +44.4 (c = 0.2, MeOH) |
| Reported Formula |
C27H36O9 |
| 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)CC1C(C)(C)O1)[H])(OC(=O)\C(C)=C/C)[H])[H] |
| SPLASH |
splash10-001i-9000000000-600a0ad914d740b6a9f0 |
| Source of Spectrum |
G4-73-142-4 |
| Wiley ID |
1846407 |
