| SpectraBase Spectrum ID |
KCxfoPug296 |
| Name |
Methyl 4,5-Dihydroxy-3-(3-hydroxy-1-oxobut-2-en-1-yl)anthracene-9,10-dion-2-acetate |
| Alternate Name(s) |
Methyl {4,5-dihydroxy-3-[(2Z)-3-hydroxy-2-butenoyl]-9,10-dioxo-9,10-dihydro-2-anthracenyl}acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H16O8 |
| InChI |
InChI=1S/C21H16O8/c1-9(22)6-14(24)16-10(8-15(25)29-2)7-12-18(20(16)27)21(28)17-11(19(12)26)4-3-5-13(17)23/h3-7,22-23,27H,8H2,1-2H3/b9-6- |
| InChIKey |
QGZMHDUMKBLKKK-TWGQIWQCSA-N |
| Molecular Weight |
396.351 g/mol |
| SMILES |
Oc1c2C(c3c(c(C(\C=C/(O)C)=O)c(cc3C(c2ccc1)=O)CC(=O)OC)O)=O |
| SPLASH |
splash10-0690-0019000000-eebf36badd3a43a7d6a7 |
| Source of Spectrum |
J-65-2855-8 |
| Wiley ID |
1532519 |
