Aconitane-4-methanol, 20-ethyl-1,6,14,16-tetramethoxy-7,8-[methylenebis(oxy)]-, 4-[2-[(3S)-3-methyl-2,5-dioxo-1-pyrrolidinyl]benzoate], (1α,6β,14α,16β)-
CAS Registry Number®
26000-16-8
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CAS Name
Aconitane-4-methanol, 20-ethyl-1,6,14,16-tetramethoxy-7,8-[methylenebis(oxy)]-, 4-[2-[(3S)-3-methyl-2,5-dioxo-1-pyrrolidinyl]benzoate], (1α,6β,14α,16β)-Molecular Formula
C38H50N2O10Molecular Mass
694.81Cite this Page
Aconitane-4-methanol, 20-ethyl-1,6,14,16-tetramethoxy-7,8-[methylenebis(oxy)]-, 4-[2-[(3S)-3-methyl-2,5-dioxo-1-pyrrolidinyl]benzoate], (1α,6β,14α,16β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=26000-16-8 (retrieved ) (CAS RN: 26000-16-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
225-227 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C38H50N2O10/c1-7-39-17-35(18-48-33(43)21-10-8-9-11-24(21)40-27(41)14-20(2)32(40)42)13-12-26(45-4)37-23-15-22-25(44-3)16-36(28(23)29(22)46-5)38(34(37)39,50-19-49-36)31(47-6)30(35)37/h8-11,20,22-23,25-26,28-31,34H,7,12-19H2,1-6H3/t20-,22+,23+,25-,26-,28+,29-,30+,31-,34-,35-,36+,37-,38+/m0/s1
InChIKey
InChIKey=KOWWOODYPWDWOJ-VDIDUINNSA-N
SMILES
O(C)[C@@H]1[C@]23[C@]4([C@]5([C@@H](OC)[C@@]2([C@](COC(=O)C6=C(C=CC=C6)N7C(=O)[C@@H](C)CC7=O)(CN4CC)CC1)[H])[C@@]8([C@@]9([C@]3(C[C@@]([C@@H]9OC)([C@@H](OC)C8)[H])[H])[H])OCO5)[H]
Canonical SMILES
O=C(OCC12CN(CC)C3C45OCOC65CC(OC)C7CC(C6C7OC)C3(C(OC)CC1)C2C4OC)C=8C=CC=CC8N9C(=O)CC(C9=O)C
Other Names for this Substance
- Aconitane-4-methanol, 20-ethyl-1,6,14,16-tetramethoxy-7,8-[methylenebis(oxy)]-, 4-[2-[(3S)-3-methyl-2,5-dioxo-1-pyrrolidinyl]benzoate], (1α,6β,14α,16β)-
- Elatine
- Aconitane-4-methanol, 20-ethyl-1,6,14,16-tetramethoxy-7,8-[methylenebis(oxy)]-, 2-[(3S)-3-methyl-2,5-dioxo-1-pyrrolidinyl]benzoate (ester), (1α,6β,14α,16β)-
- Elatin
- Elatine (alkaloid)
Deleted or Replaced CAS Registry Numbers
466-31-9
