2-[4-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-methoxyphenyl]-3,5,7-trihydroxy-4H-1-benzopyran-4-one

CAS Registry Number®

139742-27-1

CAS Name

2-[4-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-methoxyphenyl]-3,5,7-trihydroxy-4H-1-benzopyran-4-one

Molecular Formula

C28H32O16

Molecular Mass

624.54

Cite this Page

2-[4-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-methoxyphenyl]-3,5,7-trihydroxy-4H-1-benzopyran-4-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=139742-27-1 (retrieved 2024-11-04) (CAS RN: 139742-27-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H32O16/c1-9-18(32)21(35)24(38)27(40-9)44-26-22(36)19(33)16(8-29)43-28(26)42-13-4-3-10(5-14(13)39-2)25-23(37)20(34)17-12(31)6-11(30)7-15(17)41-25/h3-7,9,16,18-19,21-22,24,26-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,24+,26+,27-,28+/m0/s1

InChIKey

InChIKey=KBVVGMZQNYSITN-PDDXIVOGSA-N

SMILES

OC1=C(OC=2C(C1=O)=C(O)C=C(O)C2)C3=CC(OC)=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](O)[C@H](O)[C@@H](CO)O4)C=C3

Canonical SMILES

O=C1C(O)=C(OC=2C=C(O)C=C(O)C12)C=3C=CC(OC4OC(CO)C(O)C(O)C4OC5OC(C)C(O)C(O)C5O)=C(OC)C3

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-[4-[[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-methoxyphenyl]-3,5,7-trihydroxy-
  • 2-[4-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-methoxyphenyl]-3,5,7-trihydroxy-4H-1-benzopyran-4-one
  • Crosatoside A

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles