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Substance Name: Cannabiscitrin
RN: 520-14-9
InChIKey: ZJYAVUPWMNHHEU-GFOOFYSOSA-N

Note

  • Isolated from the flowers of Abelmoschus manihot.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H20-O13

Molecular Weight

  • 480.376
 
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Names and Synonyms

Synonyms

  • 3'-(Glucopyranosyloxy)-3,4',5,5',7-pentahydroxyflavone
  • 4-18-00-03597 (Beilstein Handbook Reference)
  • 4H-1-Benzopyran-4-one, 2-(3-(beta-D-glucopyranosyloxy)-4,5-dihydroxyphenyl)-3,5,7-trihydroxy-
  • BRN 0069547
  • Myricetin 3'-glucoside

Systematic Names

  • Cannabiscitrin
  • Flavone, 3'-(glucopyranosyloxy)-3,4',5,5',7-pentahydroxy-

Registry Numbers

CAS Registry Number

  • 520-14-9

System Generated Number

  • 0000520149

Structure Descriptors

InChI

1S/C21H20O13/c22-5-12-15(27)17(29)19(31)21(34-12)33-11-2-6(1-9(25)14(11)26)20-18(30)16(28)13-8(24)3-7(23)4-10(13)32-20/h1-4,12,15,17,19,21-27,29-31H,5H2/t12-,15-,17+,19-,21-/m1/s1

InChIKey

ZJYAVUPWMNHHEU-GFOOFYSOSA-N

Smiles

c1(cc2oc(c3cc(O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)c(O)c(O)c3)c(c(c2c(c1)O)=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2gm/kg (2000mg/kg)   Russian Pharmacology and Toxicology Vol. 48, Pg. 143, 1985.