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Substance Name: Agrimophol
RN: 65792-05-4
InChIKey: NQGCBDWQKDAGTK-UHFFFAOYSA-N

Note

  • Phenolic cpd from Agrimonia pilosa Ledeb.

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C26-H34-O8

Molecular Weight

  • 474.547
 
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Names and Synonyms

Name of Substance

  • Agrimophol

Synonyms

  • Agrimophol
  • BRN 2195872

Systematic Names

  • 2,4-Cyclohexadien-1-one, 3,5-dihydroxy-6-((2,6-dihydroxy-4-methoxy-3-methyl-5-(1-oxobutyl)phenyl)methyl)-4,6-dimethyl-2-(2-methyl-1-oxobutyl)-
  • 2,4-Cyclohexadien-1-one, 6-((2,6-dihydroxy-4-methoxy-3-methyl-5-(1-oxobutyl)phenyl)methyl)-3,5-dihydroxy-4,6-dimethyl-2-(2-methyl-1-oxobutyl)-

Registry Numbers

CAS Registry Number

  • 65792-05-4

System Generated Number

  • 0065792054

Structure Descriptors

InChI

1S/C26H34O8/c1-8-10-16(27)17-22(31)15(20(29)13(4)23(17)34-7)11-26(6)24(32)14(5)21(30)18(25(26)33)19(28)12(3)9-2/h12,29-32H,8-11H2,1-7H3

InChIKey

NQGCBDWQKDAGTK-UHFFFAOYSA-N

Smiles

C1(C(=C(C(=C([C@@]1(C)Cc1c(c(c(c(c1O)C(CCC)=O)OC)C)O)O)C)O)C([C@@H](CC)C)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 435mg/kg (435mg/kg)   Drugs of the Future. Vol. 8, Pg. 182, 1983.