Prunin

CAS Registry Number®

529-55-5
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CAS Name

Prunin

Molecular Formula

C21H22O10

Molecular Mass

434.39

Cite this Page

Prunin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=529-55-5 (retrieved 2024-05-05) (CAS RN: 529-55-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    225 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2/t14-,16+,18+,19-,20+,21+/m0/s1

InChIKey

InChIKey=DLIKSSGEMUFQOK-SFTVRKLSSA-N

SMILES

O=C1C=2C(O[C@@H](C1)C3=CC=C(O)C=C3)=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC2O

Canonical SMILES

O=C1C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3O)C=C2OC(C4=CC=C(O)C=C4)C1

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)-
  • Prunin
  • 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (S)-
  • (2S)-7-(β-D-Glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
  • Naringenin 7-glucoside

View All

Deleted or Replaced CAS Registry Numbers

30399-86-1, 31049-13-5

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