3-[[3-O-Acetyl-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-1,6-dihydroxy-2-methyl-9,10-anthracenedione

CAS Registry Number®

125906-50-5

CAS Name

3-[[3-O-Acetyl-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-1,6-dihydroxy-2-methyl-9,10-anthracenedione

Molecular Formula

C29H32O15

Molecular Mass

620.56

Cite this Page

3-[[3-O-Acetyl-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-1,6-dihydroxy-2-methyl-9,10-anthracenedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=125906-50-5 (retrieved 2024-11-13) (CAS RN: 125906-50-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H32O15/c1-9-16(7-15-18(19(9)33)22(36)13-5-4-12(32)6-14(13)21(15)35)42-29-27(26(41-11(3)31)23(37)17(8-30)43-29)44-28-25(39)24(38)20(34)10(2)40-28/h4-7,10,17,20,23-30,32-34,37-39H,8H2,1-3H3/t10-,17+,20-,23+,24+,25+,26-,27+,28-,29+/m0/s1

InChIKey

InChIKey=VUDKIFFLIMSULN-AKMBVNFTSA-N

SMILES

O=C1C=2C(C(=O)C=3C1=CC(O)=CC3)=C(O)C(C)=C(O[C@H]4[C@H](O[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)[C@@H](OC(C)=O)[C@H](O)[C@@H](CO)O4)C2

Canonical SMILES

O=C(OC1C(O)C(OC(OC=2C=C3C(=O)C4=CC(O)=CC=C4C(=O)C3=C(O)C2C)C1OC5OC(C)C(O)C(O)C5O)CO)C

Other Names for this Substance

  • 9,10-Anthracenedione, 3-[[3-O-acetyl-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-1,6-dihydroxy-2-methyl-
  • 3-[[3-O-Acetyl-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-1,6-dihydroxy-2-methyl-9,10-anthracenedione

CAS INSIGHTSTM
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