| SpectraBase Spectrum ID |
JEMHAlzGmW |
| Name |
(2S)-5-hydroxy-2-[2-hydroxy-3-(3-methylbut-2-enyl)phenyl]-8,8-dimethyl-2,3-dihydropyrano[2,3-h]chromen-4-one |
| Appearance |
Pale yellow amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H26O5 |
| InChI |
InChI=1S/C25H26O5/c1-14(2)8-9-15-6-5-7-16(23(15)28)20-12-18(26)22-19(27)13-21-17(24(22)29-20)10-11-25(3,4)30-21/h5-8,10-11,13,20,27-28H,9,12H2,1-4H3/t20-/m0/s1 |
| InChIKey |
VPMGXHDHUFGBBL-FQEVSTJZSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1004664 |
| Molecular Weight |
406.478 g/mol |
| Optical Rotation |
[a]D25= -17 (c = 0.26, MeOH) |
| Reported Formula |
C25H26O5 |
| SMILES |
Oc1cc2c(c3O[C@](c4c(c(ccc4)CC=C(C)C)O)(CC(c13)=O)[H])C=CC(O2)(C)C |
| SPLASH |
splash10-0udi-0090200000-576f6158d915f9b24a6b |
| Source of Spectrum |
G4-74-161-3 |
| Wiley ID |
1849032 |
