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Vecuronium Bromide

Vecuronium Bromide

API0231802

Vecuronium Bromide

Vecuronium Bromide is a neuromuscular blocker.

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  • CAS No.

    50700-72-6

  • Synonyms

    VECURONIUM BROMIDE; ORG NC 45; Bromuro de vecuronio

  • CHEMBL ID

    CHEMBL1200629

  • Compound CID

    39764

  • Molecular Weight (g/mol)

    637.7

  • Molecular Formula

    C34H57BrN2O4

  • InChI

    InChI=1S/C34H57N2O4.BrH/c1-23(37)39-31-20-25-12-13-26-27(34(25,4)22-29(31)35-16-8-6-9-17-35)14-15-33(3)28(26)21-30(32(33)40-24(2)38)36(5)18-10-7-11-19-36;/h25-32H,6-22H2,1-5H3;1H/q+1;/p-1/t25-,26+,27-,28-,29-,30-,31-,32-,33-,34-;/m0./s1

  • InChIKey

    VEPSYABRBFXYIB-PWXDFCLTSA-M

  • SMILES

    CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N4CCCCC4)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-]

  • IUPAC Name

    [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-16-(1-methylpiperidin-1-ium-1-yl)-2-piperidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate;bromide

  • Exact Mass (Da)

    636.35017

  • Monoisotopic Mass (Da)

    636.35017

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