2-(3,4-Dihydroxyphenyl)-8-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-4H-1-benzopyran-4-one

CAS Registry Number®

115921-09-0

CAS Name

2-(3,4-Dihydroxyphenyl)-8-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-4H-1-benzopyran-4-one

Molecular Formula

C27H30O17

Molecular Mass

626.52

Cite this Page

2-(3,4-Dihydroxyphenyl)-8-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-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=115921-09-0 (retrieved 2024-11-25) (CAS RN: 115921-09-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    243-246 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C27H30O17/c28-6-15-18(34)20(36)22(38)26(42-15)40-7-16-19(35)21(37)23(39)27(43-16)44-24-13(33)4-11(31)17-12(32)5-14(41-25(17)24)8-1-2-9(29)10(30)3-8/h1-5,15-16,18-23,26-31,33-39H,6-7H2/t15-,16-,18-,19-,20+,21+,22-,23-,26-,27+/m1/s1

InChIKey

InChIKey=AQHGCHUVXUMKOP-TUTGZWPLSA-N

SMILES

O(C1=C2C(C(=O)C=C(O2)C3=CC(O)=C(O)C=C3)=C(O)C=C1O)[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C1C=C(OC=2C(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)=C(O)C=C(O)C12)C=5C=CC(O)=C(O)C5

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-8-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-
  • 2-(3,4-Dihydroxyphenyl)-8-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-4H-1-benzopyran-4-one
  • 8-Hydroxyluteolin 8-β-gentiobiosiole
  • Hypoletin 8-O-gentiobioside

CAS INSIGHTSTM
Hourglass and a clock