| SpectraBase Spectrum ID |
44wmJIQEW1v |
| Name |
Carnosic acid .gamma.-lactone 12-indolebutyrate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H37NO4 |
| InChI |
InChI=1S/C32H37NO4/c1-19(2)23-17-20-13-14-25-31(3,4)15-8-16-32(25)27(20)29(37-30(32)35)28(23)36-26(34)12-7-9-21-18-33-24-11-6-5-10-22(21)24/h5-6,10-11,17-19,25,33H,7-9,12-16H2,1-4H3/t25?,32-/m1/s1 |
| InChIKey |
NJWOWONHNDLBAQ-YNKGCYCKSA-N |
| Instrument Name |
VG Micromass ZAB-2F |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900822x |
| Molecular Weight |
499.651 g/mol |
| Optical Rotation |
[a]D20 = +47 (c = 0.09, CHCl3) |
| Reported Formula |
C32H37NO4 |
| SMILES |
[nH]1cc(c2c1cccc2)CCCC(Oc1c(cc2c3c1OC(=O)[C@]31C(CC2)C(C)(C)CCC1)C(C)C)=O |
| SPLASH |
splash10-000i-0970200000-e8b1ef91f7422a33965a |
| Source of Spectrum |
G4-73-642-18 |
| Wiley ID |
1846425 |
