SpectraBase Spectrum ID |
BSVJaph2smK |
Name |
Carnosic acid .gamma.-lactone |
Appearance |
Colorless crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H26O3 |
InChI |
InChI=1S/C20H26O3/c1-11(2)13-10-12-6-7-14-19(3,4)8-5-9-20(14)15(12)17(16(13)21)23-18(20)22/h10-11,14,21H,5-9H2,1-4H3/t14?,20-/m1/s1 |
InChIKey |
HEHCCMUMPYGALS-YBMSBYLISA-N |
Instrument Name |
VG Micromass ZAB-2F |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/np900822x |
Molecular Weight |
314.425 g/mol |
Optical Rotation |
[a]D20 = +79 (c = 0.12, CHCl3) |
Reported Formula |
C20H26O3 |
SMILES |
Oc1c2c3[C@]4(CCCC(C4CCc3cc1C(C)C)(C)C)C(O2)=O |
SPLASH |
splash10-00li-0090000000-9269ff14e6d1a67fd493 |
Source of Spectrum |
G4-73-642-3 |
Wiley ID |
1846426 |