| SpectraBase Spectrum ID |
9pLKYFe3kpy |
| Name |
(-)-(2S)-5,7,2'-Trihydroxy-5'-(1''',1'''-dimethylallyl)-8-prenylflava-none |
| Appearance |
Amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H28O5 |
| InChI |
InChI=1S/C25H28O5/c1-6-25(4,5)15-8-10-18(26)17(11-15)22-13-21(29)23-20(28)12-19(27)16(24(23)30-22)9-7-14(2)3/h6-8,10-12,22,26-28H,1,9,13H2,2-5H3/t22-/m0/s1 |
| InChIKey |
XTXBYTLPTUGDBR-QFIPXVFZSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1004664 |
| Molecular Weight |
408.494 g/mol |
| Optical Rotation |
[a]D25 = -105 (c = 0.13, MeOH) |
| Reported Formula |
C25H28O5 |
| SMILES |
Oc1cc(c(c2O[C@](c3c(ccc(c3)C(C)(C)C=C)O)(CC(c12)=O)[H])CC=C(C)C)O |
| SPLASH |
splash10-014i-0900000000-8da44ce93abbfa2ad3e7 |
| Source of Spectrum |
G4-74-161-1 |
| Wiley ID |
1849030 |
