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| CAS No.: | 477-85-0 |
| Molecular Formula | C₁₆H₁₂O₅ |
| Molecular Weight | 284.26g/mol |
| Purity | HPLC>98% |
| Chemical Family | Anthraquinones |
IUPAC Name: 2,8-dihydroxy-1-methoxy-3-methylanthracene-9,10-dione
InChI: InChI=1S/C16H12O5/c1-7-6-9-12(16(21-2)13(7)18)15(20)11-8(14(9)19)4-3-5-10(11)17/h3-6,17-18H,1-2H3
InChIKey: NYRXUBDGDSRBGB-UHFFFAOYSA-N
Canonical SMILES: CC1=CC2=C(C(=C1O)OC)C(=O)C3=C(C2=O)C=CC=C3O
Isomeric SMILES: CC1=CC2=C(C(=C1O)OC)C(=O)C3=C(C2=O)C=CC=C3O
Synonyms: Obtusifolin; 477-85-0; Obtusifolin (anthraquinone); 2,8-dihydroxy-1-methoxy-3-methylanthracene-9,10-dione; 2,8-Dihydroxy-1-methoxy-3-methyl-9,10-anthracenedione; CHEBI:80880; Anthraquinone, 2,8-dihydroxy-1-methoxy-3-methyl-; 9,10-Anthracenedione, 2,8-dihydroxy-1-methoxy-3-methyl-; …
Botanical Source: Cassiae semen
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