Gelsemine, monohydrochloride

CAS Registry Number®

35306-33-3

CAS Name

Gelsemine, monohydrochloride

Molecular Formula

C20H22N2O2.ClH

Cite this Page

Gelsemine, monohydrochloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35306-33-3 (retrieved 2024-11-22) (CAS RN: 35306-33-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    326 °C

  • Density (2)

    1.37 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H22N2O2.ClH/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23;/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23);1H/t11-,13+,15+,16+,17-,19-,20-;/m0./s1

InChIKey

InChIKey=AVNIVHTXRYXBIV-WMTURVKQSA-N

SMILES

O=C1[C@@]2([C@@]3([C@]4(C=C)[C@@]5(C[C@]2(OC[C@@]5([C@]3(N(C)C4)[H])[H])[H])[H])[H])C=6C(N1)=CC=CC6.Cl

Canonical SMILES

Cl.O=C1NC=2C=CC=CC2C13C4OCC5C6N(C)CC(C=C)(C5C4)C63

Other Names for this Substance

  • Gelsemine, monohydrochloride
  • Spiro[3,5,8-ethanylylidene-1H-pyrano[3,4-c]pyridine-10,3′-[3H]indole], gelsemine deriv.
  • Gelsemine hydrochloride

Deleted or Replaced CAS Registry Numbers

5995-93-7