| SpectraBase Spectrum ID |
D164Q4pIXF9 |
| Name |
2-(2'-Carbomethoxymethyl-3'-oxobutyl)-1,4-dihydroxy-5-methoxyanthraquinone |
| CAS Registry Number |
66644-10-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H20O8 |
| InChI |
InChI=1S/C22H20O8/c1-10(23)11(9-16(25)30-3)7-12-8-14(24)18-19(20(12)26)21(27)13-5-4-6-15(29-2)17(13)22(18)28/h4-6,8,11,24,26H,7,9H2,1-3H3 |
| InChIKey |
ZJWZFOWXMQHVNE-UHFFFAOYSA-N |
| Molecular Weight |
412.394 g/mol |
| SMILES |
Oc1c2c(c(cc1CC(C(=O)C)CC(=O)OC)O)C(c1c(C2=O)cccc1OC)=O |
| SPLASH |
splash10-052f-3039100000-5d1540b4be558430947e |
| Source of Spectrum |
J-43-4167-0 |
| Synonyms |
Methyl 3-[(1,4-dihydroxy-5-methoxy-9,10-dioxo-9,10-dihydro-2-anthracenyl)methyl]-4-oxopentanoate |
| Wiley ID |
1374380 |
