7-(β-D-Glucopyranosyloxy)-5-hydroxy-6-(4-hydroxy-3-methyl-2-buten-1-yl)-2-methyl-4H-1-benzopyran-4-one

CAS Registry Number®

121748-72-9
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CAS Name

7-(β-D-Glucopyranosyloxy)-5-hydroxy-6-(4-hydroxy-3-methyl-2-buten-1-yl)-2-methyl-4H-1-benzopyran-4-one

Molecular Formula

C21H26O10

Molecular Mass

438.43

Cite this Page

7-(β-D-Glucopyranosyloxy)-5-hydroxy-6-(4-hydroxy-3-methyl-2-buten-1-yl)-2-methyl-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=121748-72-9 (retrieved 2024-09-19) (CAS RN: 121748-72-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H26O10/c1-9(7-22)3-4-11-13(6-14-16(17(11)25)12(24)5-10(2)29-14)30-21-20(28)19(27)18(26)15(8-23)31-21/h3,5-6,15,18-23,25-28H,4,7-8H2,1-2H3/t15-,18-,19+,20-,21-/m1/s1

InChIKey

InChIKey=VAWXDOOFPWDVPC-CMWLGVBASA-N

SMILES

OC1=C2C(=CC(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C1CC=C(CO)C)OC(C)=CC2=O

Canonical SMILES

O=C1C=C(OC=2C=C(OC3OC(CO)C(O)C(O)C3O)C(=C(O)C12)CC=C(C)CO)C

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-5-hydroxy-6-(4-hydroxy-3-methyl-2-buten-1-yl)-2-methyl-
  • 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-5-hydroxy-6-(4-hydroxy-3-methyl-2-butenyl)-2-methyl-
  • 7-(β-D-Glucopyranosyloxy)-5-hydroxy-6-(4-hydroxy-3-methyl-2-buten-1-yl)-2-methyl-4H-1-benzopyran-4-one
  • 2-Methyl-5-hydroxy-6-(3-hydroxymethyl-2-butenyl)-7-(β-D-glucopyranosyloxy)-4H-1-benzopyran-4-one