CAS 139742-39-5 appears in our catalog under these names: 1,3,6–Trihydroxy–2–methyl–9,10–anthraquinone–3–O–(6'–O–acetyl)–beta–D–xylopyranosyl–(1–>2)–beta–D–glucopyranoside, 1,3,6-Trihydroxy-2-methyl-9,10-anthraquinone-3-O-(6'-O-acetyl)-beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranoside, 3-[(6-O-Acetyl-2-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy]-1,6-dihydroxy-2-methyl-9,10-anthracenedione, ≥98%. Offered by: GLPBio, MedChemExpress, Chemat. Available pack sizes: 1mg, 5 mg, 1 mg, 5mg, 10mg, 20mg.
1,3,6-trihydroxy-2-methyl-9,10-anthraquinone-3-O-(6'-O-acetyl)-beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranoside is a disaccharide derivative that is 1,3,6-trihydroxy-2-methyl-9,10-anthraquinone attached to a (6'-O-acetyl)-beta-D-xylopyranosyl-(12)-beta-D-glucopyranosyl residue at position 3 via a glycosidic linkage. It has been isolated from the roots of Rubia yunnanensis. It has a role as a plant metabolite. It is a dihydroxyanthraquinone, an acetate ester and a disaccharide derivative. It is functionally related to a 1,3,6-trihydroxy-2-methyl-9,10-anthraquinone.
Source: ChEBI
| Molecular formula | C28H30O15 |
|---|---|
| Molecular weight | 606.5 g/mol |
| IUPAC name | [(2R,3S,4S,5R,6S)-6-(4,7-dihydroxy-3-methyl-9,10-dioxoanthracen-2-yl)oxy-3,4-dihydroxy-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]methyl acetate |
| InChIKey | JGCFTRKGKNECSV-ZIAPGWQOSA-N |
| SMILES | CC1=C(C=C2C(=C1O)C(=O)C3=C(C2=O)C=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(=O)C)O)O)O[C@H]5[C@@H]([C@H]([C@@H](CO5)O)O)O |
Computed by PubChem (NCBI)