| SpectraBase Spectrum ID |
DQ6zG941G4B |
| Name |
xanthotoxin |
| Alternate Name(s) |
Methoxsalen
Oxypsoralen
8-Methoxypsoralen
Meladinin
Ammoidin
Ammodin
9-Methoxyfuro[3,2-g]chromen-7-one
9-Methoxy-7H-furo[3,2-g]chromen-7-one |
| Comments |
CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000953 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H8O4 |
| InChI |
InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3 |
| InChIKey |
QXKHYNVANLEOEG-UHFFFAOYSA-N |
| Molecular Weight |
216.192 g/mol |
| SMILES |
COc1c2c(cco2)cc2C=CC(=O)Oc12 |
| SPLASH |
splash10-00ri-6940000000-dfd31a0ec7f549ecedfe |
| Source of Spectrum |
FM-2019-953-0 |
| Wiley ID |
1818614 |
