| SpectraBase Spectrum ID |
JXIiigNww8Q |
| Name |
Demethyl-calabaxanthone |
| Alternate Name(s) |
5,8-Dihydroxy-2,2-dimethyl-7-(3-methylbut-2-enyl)-6-pyrano[3,2-b]xanthenone
2,2-Dimethyl-7-(3-methylbut-2-enyl)-5,8-bis(oxidanyl)pyrano[3,2-b]xanthen-6-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H22O5 |
| InChI |
InChI=1S/C23H22O5/c1-12(2)5-6-13-15(24)7-8-16-19(13)22(26)20-18(27-16)11-17-14(21(20)25)9-10-23(3,4)28-17/h5,7-11,24-25H,6H2,1-4H3 |
| InChIKey |
SDKLJUCURHMDBQ-UHFFFAOYSA-N |
| Molecular Weight |
378.424 g/mol |
| SMILES |
Oc1c(c2C(c3c(c4C=CC(Oc4cc3Oc2cc1)(C)C)O)=O)CC=C(C)C |
| SPLASH |
splash10-03di-0009000000-5d2fff4ea8859eb35701 |
| Source of Spectrum |
X2-50-477-9 |
| Wiley ID |
1602261 |
