Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Malvidin chloride
RN: 643-84-5
UNII: GL5KGZ4D8U
InChIKey: KQIKOUUKQBTQBE-UHFFFAOYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C17-H15-O7.Cl

Molecular Weight

  • 366.751
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Malvidin chloride

Synonyms

  • 3,4',5,7-Tetrahydroxy-2',5'-dimethoxy-2-phenylbenzopyrylium chloride
  • 3,4',5,7-Tetrahydroxy-3',5'-dimethoxyflavylium chloride
  • EINECS 211-403-8
  • Enidin
  • Malvidin
  • Malvidin chloride
  • Malvidol
  • Malvinidin
  • Malvinidol chloride
  • NSC 94526
  • Oenidin
  • Primulidin
  • Syringidin
  • Syringidin chloride
  • UNII-GL5KGZ4D8U

Systematic Names

  • 1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-, chloride (9CI)
  • 3,5,7-Trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-benzopyryliumchloride
  • Flavylium, 3,4',5,7-tetrahydroxy-3',5'-dimethoxy-, chloride

Registry Numbers

CAS Registry Number

  • 643-84-5

FDA UNII

  • GL5KGZ4D8U

Related Registry Number

  • 10463-84-0 (Parent)

System Generated Number

  • 0000643845

Molecular Formulas

Molecular Formula

  • C17-H15-O7.Cl

Molecular Formula Fragments

  • C17-H15-O7
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C17H14O7.ClH/c1-22-14-3-8(4-15(23-2)16(14)21)17-12(20)7-10-11(19)5-9(18)6-13(10)24-17;/h3-7H,1-2H3,(H3-,18,19,20,21);1H

InChIKey

KQIKOUUKQBTQBE-UHFFFAOYSA-N

Smiles

c1(cc(c2c(c1)[o+]c(c(c2)O)c1cc(c(c(c1)OC)O)OC)O)O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01634,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point >300 deg C   EXP
log P (octanol-water) 2.330 (none)   EST
Atmospheric OH Rate Constant 2.89E-10 cm3/molecule-sec 25 EST

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