(1α,6β,14α,16β)-20-Ethyl-1,14,16-trimethoxy-4-(methoxymethyl)-7,8-[methylenebis(oxy)]aconitan-6-ol

CAS Registry Number®

52358-55-1
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CAS Name

(1α,6β,14α,16β)-20-Ethyl-1,14,16-trimethoxy-4-(methoxymethyl)-7,8-[methylenebis(oxy)]aconitan-6-ol

Molecular Formula

C26H41NO7

Molecular Mass

479.61

Cite this Page

(1α,6β,14α,16β)-20-Ethyl-1,14,16-trimethoxy-4-(methoxymethyl)-7,8-[methylenebis(oxy)]aconitan-6-ol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52358-55-1 (retrieved 2024-09-19) (CAS RN: 52358-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H41NO7/c1-6-27-11-23(12-29-2)8-7-17(31-4)25-15-9-14-16(30-3)10-24(18(15)19(14)32-5)26(22(25)27,34-13-33-24)21(28)20(23)25/h14-22,28H,6-13H2,1-5H3/t14-,15-,16+,17+,18-,19+,20-,21+,22+,23+,24-,25+,26-/m1/s1

InChIKey

InChIKey=XTLROSDJDZHIIK-FQCWPTJPSA-N

SMILES

O(C)[C@@H]1[C@]23[C@]4([C@]5([C@@H](O)[C@@]2([C@](COC)(CN4CC)CC1)[H])[C@@]6([C@@]7([C@]3(C[C@@]([C@@H]7OC)([C@@H](OC)C6)[H])[H])[H])OCO5)[H]

Canonical SMILES

OC1C2C3(COC)CN(CC)C4C51OCOC65CC(OC)C7CC(C6C7OC)C42C(OC)CC3

Other Names for this Substance

  • Aconitan-6-ol, 20-ethyl-1,14,16-trimethoxy-4-(methoxymethyl)-7,8-[methylenebis(oxy)]-, (1α,6β,14α,16β)-
  • 9H-14b,8a,12-Ethanylylidene-6,8-methano-8aH-1,3-dioxolo[1,8a]naphth[2,3-b]azocine, aconitan-6-ol deriv.
  • (1α,6β,14α,16β)-20-Ethyl-1,14,16-trimethoxy-4-(methoxymethyl)-7,8-[methylenebis(oxy)]aconitan-6-ol
  • Delcorine
  • (-)-Delcorine