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Substance Name: Phlorhizin
RN: 60-81-1
UNII: CU9S17279X
InChIKey: IOUVKUPGCMBWBT-QNDFHXLGSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C21-H24-O10

Molecular Weight

  • 436.411
 
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Names and Synonyms

Name of Substance

  • Phlorhizin

MeSH Heading

  • Phlorhizin

Synonyms

  • AI3-19835
  • EINECS 200-487-1
  • Floridzin
  • NSC 2833
  • Phloretin 2'-glucoside
  • Phloretin-2'-O-beta-glucoside
  • Phlorhizin
  • Phloridzin
  • Phlorizin
  • Phlorizoside
  • Phlorrhizin
  • UNII-CU9S17279X

Systematic Names

  • 1-Propanone, 1-(2-(beta-D-glucopyranosyloxy)-4,6-dihydroxyphenyl)-3-(4-hydroxyphenyl)-
  • 2'-(beta-D-Glucopyranosyloxy)-4',6'-dihydroxy-3-(4-hydroxyphenyl)propiophenone
  • Phlorizin

Registry Numbers

CAS Registry Number

  • 60-81-1

FDA UNII

  • CU9S17279X

Other Registry Numbers

  • 112318-65-7
  • 16055-86-0
  • 52276-56-9

System Generated Number

  • 0000060811

Structure Descriptors

InChI

1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16-,18-,19+,20-,21-/m1/s1

InChIKey

IOUVKUPGCMBWBT-QNDFHXLGSA-N

Smiles

c1(c(O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)cc(O)cc1O)C(CCc1ccc(O)cc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 6, Pg. 226, 1954.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 110 deg C   EXP
log P (octanol-water) 0.720 (none)   EST
Water Solubility 1000 mg/L 22 EXP
Atmospheric OH Rate Constant 2.67E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.