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Substance Name: Yohimban-17-alpha-ol, 16-alpha-chloromethyl-
RN: 522-71-4
InChIKey: GZFASIBQMJFPJC-DKWZOFSHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-Cl-N2-O

Molecular Weight

  • 344.884
 
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Names and Synonyms

Synonym

  • 16-alpha-Chloromethylyohimbol

Systematic Name

  • Yohimban-17-alpha-ol, 16-alpha-chloromethyl-

Registry Numbers

CAS Registry Number

  • 522-71-4

System Generated Number

  • 0000522714

Structure Descriptors

InChI

1S/C20H25ClN2O/c21-10-16-15-9-18-20-14(13-3-1-2-4-17(13)22-20)7-8-23(18)11-12(15)5-6-19(16)24/h1-4,12,15-16,18-19,22,24H,5-11H2/t12-,15-,16+,18-,19-/m0/s1

InChIKey

GZFASIBQMJFPJC-DKWZOFSHSA-N

Smiles

c1ccc2[nH]c3c(c2c1)CC[N@@]1C[C@H]2[C@H](C[C@@H]31)[C@H]([C@H](CC2)O)CCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 338, 1965.