Picein

CAS Registry Number®

530-14-3
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CAS Name

Picein

Molecular Formula

C14H18O7

Molecular Mass

298.29

Cite this Page

Picein.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=530-14-3 (retrieved 2024-04-27) (CAS RN: 530-14-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    195.5 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C14H18O7/c1-7(16)8-2-4-9(5-3-8)20-14-13(19)12(18)11(17)10(6-15)21-14/h2-5,10-15,17-19H,6H2,1H3/t10-,11-,12+,13-,14-/m1/s1

InChIKey

InChIKey=GOZCEKPKECLKNO-RKQHYHRCSA-N

SMILES

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C2=CC=C(C(C)=O)C=C2

Canonical SMILES

O=C(C1=CC=C(OC2OC(CO)C(O)C(O)C2O)C=C1)C

Other Names for this Substance

  • Ethanone, 1-[4-(β-D-glucopyranosyloxy)phenyl]-
  • Picein
  • 1-[4-(β-D-Glucopyranosyloxy)phenyl]ethanone
  • Piceoside
  • Ameliaroside

Deleted or Replaced CAS Registry Numbers

1194723-63-1

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