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Substance Name: 3,17-bis-deacetylvecuronium
RN: 73319-30-9
UNII: 60OOL7F2LC
InChIKey: DIGWZHJLXJPNBY-DSBFZBMTSA-M

Molecular Formula

  • C30-H53-N2-O2.Br

Molecular Weight

  • 553.6647
 
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Names and Synonyms

Name of Substance

  • 3,17-Bis-deacetylvecuronium

Synonyms

  • 3,17-Bis-deacetylvecuronium
  • 3,17-Desacetylvecuronium
  • 3,17-Dihydroxyvecuronium
  • Org 7402
  • Org-7402
  • UNII-60OOL7F2LC

Systematic Name

  • Piperidinium, 1-((2beta,3alpha,5alpha,16beta,17beta)-3,17-dihydroxy-2-(1-piperidinyl)androstan-16-yl)-1-methyl-, bromide

Registry Numbers

CAS Registry Number

  • 73319-30-9

FDA UNII

  • 60OOL7F2LC

System Generated Number

  • 0073319309

Molecular Formulas

Molecular Formula

  • C30-H53-N2-O2.Br

Molecular Formula Fragments

  • Br
  • C30-H53-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C30H53N2O2.BrH/c1-29-13-12-23-22(24(29)19-26(28(29)34)32(3)16-8-5-9-17-32)11-10-21-18-27(33)25(20-30(21,23)2)31-14-6-4-7-15-31;/h21-28,33-34H,4-20H2,1-3H3;1H/q+1;/p-1/t21-,22+,23-,24-,25-,26-,27-,28-,29-,30-;/m0./s1

InChIKey

DIGWZHJLXJPNBY-DSBFZBMTSA-M

Smiles

C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]([C@@H]2O)[N+]4(CCCCC4)C)CC[C@@H]5[C@@]3(C[C@@H]([C@H](C5)O)N6CCCCC6)C.[Br-]