4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6-[2-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranosyl]-5,7-dihydroxy-, (E)-

CAS Registry Number®

57186-26-2

CAS Name

4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6-[2-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranosyl]-5,7-dihydroxy-, (E)-

Molecular Formula

C30H26O14

Molecular Mass

610.52

Cite this Page

4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6-[2-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranosyl]-5,7-dihydroxy-, (E)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57186-26-2 (retrieved 2024-11-04) (CAS RN: 57186-26-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H26O14/c31-11-22-26(39)28(41)30(44-23(38)6-2-12-1-4-14(32)16(34)7-12)29(43-22)25-19(37)10-21-24(27(25)40)18(36)9-20(42-21)13-3-5-15(33)17(35)8-13/h1-10,22,26,28-35,37,39-41H,11H2/b6-2+/t22-,26-,28+,29+,30-/m1/s1

InChIKey

InChIKey=LNXLYKZTPRBUPL-NUSNCJSNSA-N

SMILES

OC=1C(=C(O)C=C2C1C(=O)C=C(O2)C3=CC(O)=C(O)C=C3)[C@H]4[C@H](OC(/C=C/C5=CC(O)=C(O)C=C5)=O)[C@@H](O)[C@H](O)[C@@H](CO)O4

Canonical SMILES

O=C(OC1C(O)C(O)C(OC1C2=C(O)C=C3OC(=CC(=O)C3=C2O)C=4C=CC(O)=C(O)C4)CO)C=CC5=CC=C(O)C(O)=C5

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6-[2-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranosyl]-5,7-dihydroxy-, (E)-
  • 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2′-ester with 2-(3,4-dihydroxyphenyl)-6-β-D-glucopyranosyl-5,7-dihydroxy-4H-1-benzopyran-4-one, (E)-
  • 2′′-trans-Caffeoylisoorientin

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles