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Substance Name: Pachypodol
RN: 33708-72-4
UNII: 8AG6B2DMP5
InChIKey: KQFUXLQBMQGNRT-UHFFFAOYSA-N

Note

  • New flavonoid isolated from Pachypodanthium confine; from Chinese herb Agastache folium.

Molecular Formula

  • C18-H16-O7

Molecular Weight

  • 344.3174
 
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Names and Synonyms

Name of Substance

  • Pachypodol

Synonyms

  • 3,7,3'-Quercetol trimethyl ether-5,4'-dihydroxy-
  • 4',5-Dihydroxy-3,3',7-trimethoxyflavone
  • NSC 168805
  • Ro 09-0179
  • UNII-8AG6B2DMP5

Systematic Name

  • 4H-1-Benzopyran-4-one, 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,7-dimethoxy-

Registry Numbers

CAS Registry Number

  • 33708-72-4

FDA UNII

  • 8AG6B2DMP5

System Generated Number

  • 0033708724

Structure Descriptors

InChI

1S/C18H16O7/c1-22-10-7-12(20)15-14(8-10)25-17(18(24-3)16(15)21)9-4-5-11(19)13(6-9)23-2/h4-8,19-20H,1-3H3

InChIKey

KQFUXLQBMQGNRT-UHFFFAOYSA-N

Smiles

COC1=C(Oc2cc(OC)cc(O)c2C1=O)c3ccc(O)c(OC)c3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4352792,
mouse LD50 oral > 5gm/kg (5000mg/kg)   United States Patent Document. Vol. #4352792,