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| CAS No.: | 8015-61-0 |
| Molecular Formula | C₂₁H₂₂O₉ |
| Molecular Weight | 418.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Anthraquinones |
IUPAC Name: 1,8-dihydroxy-3-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
InChI: InChI=1S/C21H22O9/c22-6-8-4-10-14(21-20(29)19(28)17(26)13(7-23)30-21)9-2-1-3-11(24)15(9)18(27)16(10)12(25)5-8/h1-5,13-14,17,19-26,28-29H,6-7H2
InChIKey: AFHJQYHRLPMKHU-UHFFFAOYSA-N
Canonical SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO
Isomeric SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO
Synonyms: aloin; Aloinum; Barbaloin; 8015-61-0; 20226-90-8; 1,8-dihydroxy-3-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one; NSC407305; 73649-93-1; …
Botanical Source: Aloe
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