| SpectraBase Spectrum ID |
1gyPOADroPQ |
| Name |
Dolabellanone 5 |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32O4 |
| InChI |
InChI=1S/C22H32O4/c1-13(2)20-16-9-10-22(6)19(26-22)8-7-14(3)18(25-15(4)23)12-21(16,5)11-17(20)24/h16,18-19H,3,7-12H2,1-2,4-6H3/t16-,18+,19+,21+,22+/m1/s1 |
| InChIKey |
IALLGZZKSNMRMB-XTYSOYBWSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np100074r |
| Molecular Weight |
360.494 g/mol |
| Optical Rotation |
[a]D25 = -7.4 (c = 1.3, CHCl3) |
| Reported Formula |
C22H32O4 |
| SMILES |
[C@@]12([C@](CCC([C@](C[C@]3([C@](CC2)(C(C(C3)=O)=C(C)C)[H])C)(OC(C)=O)[H])=C)(O1)[H])C |
| SPLASH |
splash10-03di-9300000000-0277db1578efac4611b8 |
| Source of Spectrum |
G4-73-932-5 |
| Wiley ID |
1848969 |
