3-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-1,6-dihydroxy-2-(hydroxymethyl)-9,10-anthracenedione
CAS Registry Number®
1338589-00-6
CAS Name
3-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-1,6-dihydroxy-2-(hydroxymethyl)-9,10-anthracenedioneMolecular Formula
C23H22O12Molecular Mass
490.41Cite this Page
3-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-1,6-dihydroxy-2-(hydroxymethyl)-9,10-anthracenedione. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1338589-00-6 (retrieved ) (CAS RN: 1338589-00-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C23H22O12/c1-8(25)33-7-15-20(30)21(31)22(32)23(35-15)34-14-5-12-16(19(29)13(14)6-24)18(28)10-3-2-9(26)4-11(10)17(12)27/h2-5,15,20-24,26,29-32H,6-7H2,1H3/t15-,20-,21+,22-,23-/m1/s1
InChIKey
InChIKey=ULHSDDHTXWHHDP-NOGCDZMRSA-N
SMILES
O=C1C=2C(C(=O)C=3C1=CC(O)=CC3)=C(O)C(CO)=C(O[C@@H]4O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]4O)C2
Canonical SMILES
O=C(OCC1OC(OC=2C=C3C(=O)C4=CC(O)=CC=C4C(=O)C3=C(O)C2CO)C(O)C(O)C1O)C
Other Names for this Substance
- 9,10-Anthracenedione, 3-[(6-O-acetyl-β-D-glucopyranosyl)oxy]-1,6-dihydroxy-2-(hydroxymethyl)-
- 3-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-1,6-dihydroxy-2-(hydroxymethyl)-9,10-anthracenedione
