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Substance Name: Yohimban-17-ol, 18-benzylidene-
RN: 28529-01-3
InChIKey: BRAKELMHNDSLJA-ZEMSXUJDSA-N

Molecular Formula

  • C26-H28-N2-O

Molecular Weight

  • 384.52
 
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Names and Synonyms

Synonyms

  • 18-Benzylidene-17-hydroxyyohimbane
  • 18-Benzylideneyohimban-17-ol

Systematic Name

  • Yohimban-17-ol, 18-benzylidene-

Registry Numbers

CAS Registry Number

  • 28529-01-3

System Generated Number

  • 0028529013

Structure Descriptors

InChI

1S/C26H28N2O/c29-25-15-18-14-24-26-22(21-8-4-5-9-23(21)27-26)10-11-28(24)16-20(18)13-19(25)12-17-6-2-1-3-7-17/h1-9,12,18,20,24-25,27,29H,10-11,13-16H2/b19-12-/t18-,20+,24+,25?/m1/s1

InChIKey

BRAKELMHNDSLJA-ZEMSXUJDSA-N

Smiles

[nH]1c2[C@H]3[N@@](CCc2c2ccccc12)C[C@@H]1C\C([C@@H](C[C@@H]1C3)O)=C\c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   National Technical Information Service. Vol. AD691-490,