| SpectraBase Spectrum ID |
Hl4pK1iCGL2 |
| Name |
9,10-Anthracenedione, 2-hydroxy-4,5,7-trimethoxy-1-(1-oxobutyl)- |
| Alternate Name(s) |
1-Butyryl-2-hydroxy-4,5,7-trimethoxyanthra-9,10-quinone
Rhodocomatulin 1,6,8-trimethyl ether |
| CAS Registry Number |
80589-39-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H20O7 |
| InChI |
InChI=1S/C21H20O7/c1-5-6-12(22)17-13(23)9-15(28-4)18-19(17)20(24)11-7-10(26-2)8-14(27-3)16(11)21(18)25/h7-9,23H,5-6H2,1-4H3 |
| InChIKey |
VJHGJOVBCLUCHA-UHFFFAOYSA-N |
| Molecular Weight |
384.384 g/mol |
| SMILES |
Oc1cc(c2c(C(=O)c3c(C2=O)c(cc(OC)c3)OC)c1C(=O)CCC)OC |
| SPLASH |
splash10-0006-0009000000-5ca8934ba10bc0b3d102 |
| Source of Spectrum |
B-34-2391-0 |
| Wiley ID |
1361506 |
