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Substance Name: Lindleyin
RN: 59282-56-3
InChIKey: BJYRNIFAMMOVGW-OXUVVOBNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H26-O11

Molecular Weight

  • 478.447
 
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Names and Synonyms

Name of Substance

  • Lindleyin

Synonyms

  • (4-(4'-Hydroxyphenyl)-2-butanone-4'-O-beta-D-(6''-O-gallyl)glucopyranoside)
  • BRN 1672532
  • Lindleyin

Systematic Names

  • 4-(4'-Hydroxyphenyl)-2-butanone-4'-O-beta-D-(6''-O-gallyl)glucopyranoside
  • Benzoic acid, 3,4,5-trihydroxy-, 6'-ester with 4-(4-(beta-D-glucopyranosyloxy)phenyl)-2-butanone

Registry Numbers

CAS Registry Number

  • 59282-56-3

System Generated Number

  • 0059282563

Structure Descriptors

InChI

1S/C23H26O11/c1-11(24)2-3-12-4-6-14(7-5-12)33-23-21(30)20(29)19(28)17(34-23)10-32-22(31)13-8-15(25)18(27)16(26)9-13/h4-9,17,19-21,23,25-30H,2-3,10H2,1H3/t17-,19-,20+,21-,23-/m1/s1

InChIKey

BJYRNIFAMMOVGW-OXUVVOBNSA-N

Smiles

O1[C@@H](Oc2ccc(CCC(C)=O)cc2)[C@@H]([C@@H](O)[C@@H]([C@H]1COC(c1cc(c(O)c(c1)O)O)=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1260mg/kg (1260mg/kg)   Farmaco, Edizione Scientifica. Vol. 33, Pg. 460, 1978.
mouse LD50 intravenous 395mg/kg (395mg/kg)   Farmaco, Edizione Scientifica. Vol. 33, Pg. 460, 1978.
mouse LD50 oral 2190mg/kg (2190mg/kg)   Farmaco, Edizione Scientifica. Vol. 33, Pg. 460, 1978.