(3Z,5R,6S,14aR,14bS)-3-Ethylidene-2,3,4,5,6,7,9,11,13,14,14a,14b-dodecahydro-6,14b-dihydroxy-6-(hydroxymethyl)-5,12-dimethyl-2,7-dioxo[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizinium

CAS Registry Number®

26782-43-4

CAS Name

(3Z,5R,6S,14aR,14bS)-3-Ethylidene-2,3,4,5,6,7,9,11,13,14,14a,14b-dodecahydro-6,14b-dihydroxy-6-(hydroxymethyl)-5,12-dimethyl-2,7-dioxo[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizinium

Molecular Formula

C19H28NO7

Molecular Mass

382.43

Cite this Page

(3Z,5R,6S,14aR,14bS)-3-Ethylidene-2,3,4,5,6,7,9,11,13,14,14a,14b-dodecahydro-6,14b-dihydroxy-6-(hydroxymethyl)-5,12-dimethyl-2,7-dioxo[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizinium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=26782-43-4 (retrieved 2025-05-18) (CAS RN: 26782-43-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    124-125 °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/C19H28NO7/c1-4-13-9-12(2)18(24,11-21)17(23)26-10-14-5-7-20(3)8-6-15(19(14,20)25)27-16(13)22/h4-5,12,15,21,24-25H,6-11H2,1-3H3/q+1/b13-4-/t12-,15-,18-,19+,20?/m1/s1

InChIKey

InChIKey=CRWHRMSWJOLABX-NXWCFRFGSA-N

SMILES

O[C@]12[N+]3(C)CC[C@]1(OC(=O)/C(=C\C)/C[C@@H](C)[C@@](CO)(O)C(=O)OCC2=CC3)[H]

Canonical SMILES

O=C1OC2CC[N+]3(C)CC=C(COC(=O)C(O)(CO)C(C)CC1=CC)C23O

Other Names for this Substance

  • [1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizinium, 3-ethylidene-2,3,4,5,6,7,9,11,13,14,14a,14b-dodecahydro-6,14b-dihydroxy-6-(hydroxymethyl)-5,12-dimethyl-2,7-dioxo-, (3Z,5R,6S,14aR,14bS)-
  • Senkirkine, hydroxy-
  • Senecionanium, 8,12,18-trihydroxy-4-methyl-11,16-dioxo-
  • [1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine, senecionanium deriv.
  • (3Z,5R,6S,14aR,14bS)-3-Ethylidene-2,3,4,5,6,7,9,11,13,14,14a,14b-dodecahydro-6,14b-dihydroxy-6-(hydroxymethyl)-5,12-dimethyl-2,7-dioxo[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizinium

View All

Deleted or Replaced CAS Registry Numbers

26782-53-6

CAS INSIGHTSTM
Someone sitting at a desk watching a webinar