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Substance Name: Grayanotoxan-6-one, 10,20-didehydro-3,5,14,16-tetrahydroxy-, (3-beta,14R)-
RN: 28371-51-9
InChIKey: GTIDMADMEINXCZ-IOMJJTKHSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C20-H30-O5

Molecular Weight

  • 350.452
 
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Names and Synonyms

Synonyms

  • (3-beta,14R)-10,20-Didehydro-3,5,14,16-tetrahydroxygrayanotoxan-6-one
  • 6-Dehydrograyanotoxin II
  • BRN 2674036

Systematic Name

  • Grayanotoxan-6-one, 10,20-didehydro-3,5,14,16-tetrahydroxy-, (3-beta,14R)-

Registry Numbers

CAS Registry Number

  • 28371-51-9

System Generated Number

  • 0028371519

Structure Descriptors

InChI

1S/C20H30O5/c1-10-11-5-6-12-16(23)19(11,9-18(12,4)24)8-15(22)20(25)13(10)7-14(21)17(20,2)3/h11-14,16,21,23-25H,1,5-9H2,2-4H3/t11-,12?,13-,14-,16-,18+,19?,20-/m0/s1

InChIKey

GTIDMADMEINXCZ-IOMJJTKHSA-N

Smiles

C[C@]1(O)[C@@H]2CC[C@@H]3[C@@](CC([C@@]4([C@H](C[C@@H](O)C4(C)C)C3=C)O)=O)(C1)[C@@H]2O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: ATAXIA
Toxicology and Applied Pharmacology. Vol. 35, Pg. 303, 1976.