Phyllodulcin

CAS Registry Number®

21499-23-0

CAS Name

Phyllodulcin

Molecular Formula

C16H14O5

Molecular Mass

286.28

Cite this Page

Phyllodulcin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21499-23-0 (retrieved 2024-11-29) (CAS RN: 21499-23-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    120 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H14O5/c1-20-13-6-5-9(7-12(13)18)14-8-10-3-2-4-11(17)15(10)16(19)21-14/h2-7,14,17-18H,8H2,1H3/t14-/m1/s1

InChIKey

InChIKey=PBILBHLAPJTJOT-CQSZACIVSA-N

SMILES

O=C1C=2C(C[C@@H](O1)C3=CC(O)=C(OC)C=C3)=CC=CC2O

Canonical SMILES

O=C1OC(C2=CC=C(OC)C(O)=C2)CC=3C=CC=C(O)C13

Other Names for this Substance

  • 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-, (3R)-
  • Isocoumarin, 3,4-dihydro-8-hydroxy-3β-(3-hydroxy-4-methoxyphenyl)-
  • 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-, (R)-
  • (3R)-3,4-Dihydro-8-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-1H-2-benzopyran-1-one
  • Phyllodulcin

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