Delsoline

CAS Registry Number®

509-18-2

CAS Name

Delsoline

Molecular Formula

C25H41NO7

Molecular Mass

467.60

Cite this Page

Delsoline.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=509-18-2 (retrieved 2024-11-26) (CAS RN: 509-18-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    214 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1

InChIKey

InChIKey=JVBLTQQBEQQLEV-DIZROUMASA-N

SMILES

O[C@@H]1[C@@]23[C@]4([C@](COC)(CN(CC)[C@@]2([C@](O)([C@H]4OC)[C@]5(O)[C@@]6([C@]3(C[C@@]([C@@H]6OC)([C@@H](OC)C5)[H])[H])[H])[H])CC1)[H]

Canonical SMILES

OC1CCC2(COC)CN(CC)C3C4(O)C(OC)C2C13C5CC6C(OC)CC4(O)C5C6OC

Other Names for this Substance

  • Aconitane-1,7,8-triol, 20-ethyl-6,14,16-trimethoxy-4-(methoxymethyl)-, (1α,6β,14α,16β)-
  • Delsoline
  • 2H-12,3,6a-Ethanylylidene-7,9-methanonaphth[2,3-b]azocine, aconitane-1,7,8-triol deriv.
  • (1α,6β,14α,16β)-20-Ethyl-6,14,16-trimethoxy-4-(methoxymethyl)aconitane-1,7,8-triol
  • Acomonine

View All

Deleted or Replaced CAS Registry Numbers

54191-56-9

CAS INSIGHTSTM
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