Veratridine

CAS Registry Number®

71-62-5
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CAS Name

Veratridine

Molecular Formula

C36H51NO11

Molecular Mass

673.79

Cite this Page

Veratridine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=71-62-5 (retrieved 2024-04-26) (CAS RN: 71-62-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    180 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C36H51NO11/c1-19-6-11-26-31(3,40)35(43)25(17-37(26)16-19)33(42)18-34-24(32(33,41)15-27(35)38)10-9-23-30(34,2)13-12-28(36(23,44)48-34)47-29(39)20-7-8-21(45-4)22(14-20)46-5/h7-8,14,19,23-28,38,40-44H,6,9-13,15-18H2,1-5H3/t19-,23-,24-,25-,26-,27-,28-,30-,31+,32+,33+,34+,35-,36-/m0/s1

InChIKey

InChIKey=FVECELJHCSPHKY-YFUMOZOISA-N

SMILES

C[C@@]12[C@]34[C@]([C@@]5(O)[C@@](O)(C3)[C@]6([C@](O)([C@@H](O)C5)[C@](C)(O)[C@]7(N(C6)C[C@@H](C)CC7)[H])[H])(CC[C@@]1([C@](O)(O4)[C@@H](OC(=O)C8=CC(OC)=C(OC)C=C8)CC2)[H])[H]

Canonical SMILES

O=C(OC1CCC2(C)C3CCC4C5(O)CC(O)C6(O)C(CN7CC(C)CCC7C6(O)C)C5(O)CC42OC13O)C8=CC=C(OC)C(OC)=C8

Other Names for this Substance

  • Cevane-3,4,12,14,16,17,20-heptol, 4,9-epoxy-, 3-(3,4-dimethoxybenzoate), (3β,4α,16β)-
  • Veratridine
  • 3-Veratroylveracevine
  • Veracevine, veratrate
  • NSC 7524

View All

Deleted or Replaced CAS Registry Numbers

25902-60-7

CAS INSIGHTSTM
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