| SpectraBase Spectrum ID |
247Vhmvdi53 |
| Name |
Carnosic acid .gamma.-lactone 12-indoleacetate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H33NO4 |
| InChI |
InChI=1S/C30H33NO4/c1-17(2)21-14-18-10-11-23-29(3,4)12-7-13-30(23)25(18)27(35-28(30)33)26(21)34-24(32)15-19-16-31-22-9-6-5-8-20(19)22/h5-6,8-9,14,16-17,23,31H,7,10-13,15H2,1-4H3/t23?,30-/m1/s1 |
| InChIKey |
SUGGGTAXAJKYCP-JSTCWRMYSA-N |
| Instrument Name |
VG Micromass ZAB-2F |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900822x |
| Molecular Weight |
471.597 g/mol |
| Optical Rotation |
[a]D20 = +45 (c = 0.10, CHCl3) |
| Reported Formula |
C30H33NO4 |
| SMILES |
[nH]1cc(c2c1cccc2)CC(Oc1c(cc2c3c1OC(=O)[C@]31C(CC2)C(C)(C)CCC1)C(C)C)=O |
| SPLASH |
splash10-001i-0930100000-719446e02a9e37b93c3b |
| Source of Spectrum |
G4-73-642-17 |
| Wiley ID |
1846424 |
