| SpectraBase Spectrum ID |
7hXFSbyVM |
| Name |
9-trans-Acetyl-7,8,9,10-tetrahydro-6,7-rel,9-cis,11-tetrahydroxy-2,3-dimethyl-5,12-naphthacenequinone |
| Alternate Name(s) |
(7S,9S)-9-acetyl-6,7,9,11-tetrahydroxy-2,3-dimethyl-7,8,9,10-tetrahydrotetracene-5,12-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H20O7 |
| InChI |
InChI=1S/C22H20O7/c1-8-4-11-12(5-9(8)2)19(26)17-16(18(11)25)20(27)13-6-22(29,10(3)23)7-14(24)15(13)21(17)28/h4-5,14,24,27-29H,6-7H2,1-3H3/t14-,22-/m0/s1 |
| InChIKey |
CLMJHPMCBPSVAP-FPTDNZKUSA-N |
| Molecular Weight |
396.395 g/mol |
| SMILES |
Oc1c2C[C@@](C[C@@](c2c(c2C(c3c(C(c12)=O)cc(c(c3)C)C)=O)O)(O)[H])(O)C(=O)C |
| SPLASH |
splash10-01p2-0009000000-f2f940fe9dd34ace5754 |
| Source of Spectrum |
K-113-2985-10 |
| Wiley ID |
1792809 |
