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| CAS No.: | 38840-23-2 |
| Molecular Formula | C₂₁H₂₀O₁₀ |
| Molecular Weight | 432.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Anthraquinones |
IUPAC Name: 1,3-dihydroxy-6-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-9,10-dione
InChI: InChI=1S/C21H20O10/c1-7-2-9-15(18(27)14-10(16(9)25)4-8(23)5-11(14)24)12(3-7)30-21-20(29)19(28)17(26)13(6-22)31-21/h2-5,13,17,19-24,26,28-29H,6H2,1H3/t13-,17-,19+,20-,21-/m1/s1
InChIKey: ZXXFEBMBNPRRSI-JNHRPPPUSA-N
Canonical SMILES: CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)O
Isomeric SMILES: CC1=CC2=C(C(=C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)O
Synonyms: 38840-23-2; Emodin 1-O-beta-D-glucoside; Emodin-1-O-glucoside; Emodin-1-O-; A-D-glucopyranoside; Emodin-1-Beta-D-Glucoside; 513F53H6BU; UNII-513F53H6BU; …
Botanical Source: Rheum palmatum L．
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