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Substance Name: Jervine, acetate
RN: 64047-51-4
UNII: K01ZXO2SIH
InChIKey: JEDVQALXWXZHFN-AVEQMEPMSA-N

Molecular Formula

  • C27-H39-N-O3.C2-H4-O2

Molecular Weight

  • 485.6607
 
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Names and Synonyms

Name of Substance

  • Jervine, acetate

Synonyms

  • Jervine, acetate
  • Spiro(9H-benzo(a)fluorene-9,2'(3'H)-furo(3,2-b)pyridine), vertatraman-11-one deriv.
  • UNII-K01ZXO2SIH

Systematic Name

  • Veratraman-11-one, 17,23-epoxy-3-hydroxy-, (3beta,23beta)-, acetate (salt)

Registry Numbers

CAS Registry Number

  • 64047-51-4

FDA UNII

  • K01ZXO2SIH

System Generated Number

  • 0064047514

Molecular Formulas

Molecular Formula

  • C27-H39-N-O3.C2-H4-O2

Molecular Formula Fragments

  • C2-H4-O2
  • C27-H39-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C27H39NO3.C2H4O2/c1-14-11-21-24(28-13-14)16(3)27(31-21)10-8-19-20-6-5-17-12-18(29)7-9-26(17,4)23(20)25(30)22(19)15(27)2;1-2(3)4/h5,14,16,18-21,23-24,28-29H,6-13H2,1-4H3;1H3,(H,3,4)/t14-,16+,18-,19-,20-,21+,23+,24-,26-,27-;/m0./s1

InChIKey

JEDVQALXWXZHFN-AVEQMEPMSA-N

Smiles

C[C@@H]1CN[C@@H]2[C@@H](C1)O[C@]3(CC[C@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@H]5C(=O)C4=C3C)[C@@H]2C.CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 9300ug/kg (9.3mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: EXCITEMENT
Journal of Pharmacology and Experimental Therapeutics. Vol. 82, Pg. 167, 1944.