Foresaconitine
CAS Registry Number®
73870-35-6
CAS Name
ForesaconitineMolecular Formula
C35H49NO9Molecular Mass
627.76Cite this Page
Foresaconitine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=73870-35-6 (retrieved ) (CAS RN: 73870-35-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C35H49NO9/c1-8-36-17-33(18-39-3)14-13-25(42-6)35-23-15-22-24(41-5)16-34(45-19(2)37,27(31(35)36)29(43-7)30(33)35)26(23)28(22)44-32(38)20-9-11-21(40-4)12-10-20/h9-12,22-31H,8,13-18H2,1-7H3/t22-,23-,24+,25+,26-,27+,28+,29+,30-,31-,33+,34-,35+/m1/s1
InChIKey
InChIKey=LYUPEIXJYAJCHL-YKLHRILBSA-N
SMILES
O(C)[C@@H]1[C@@]23[C@]4([C@](COC)(CN(CC)[C@@]2([C@]([C@@H]4OC)([C@]5(OC(C)=O)[C@@]6([C@]3(C[C@@]([C@@H]6OC(=O)C7=CC=C(OC)C=C7)([C@@H](OC)C5)[H])[H])[H])[H])[H])CC1)[H]
Canonical SMILES
O=C(OC1C2CC3C1C(OC(=O)C)(CC2OC)C4C(OC)C5C6(COC)CN(CC)C4C35C(OC)CC6)C7=CC=C(OC)C=C7
Other Names for this Substance
- Aconitane-8,14-diol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-(4-methoxybenzoate), (1α,6α,14α,16β)-
- 11aH-12,3,6a-Ethanylylidene-7,9-methanonaphth[2,3-b]azocine, aconitane-8,14-diol deriv.
- Vilmorrianine C
- Chasmanine 8-acetate 14-(p-methoxybenzoate)
- Foresaconitine