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Chemical structure of Cevadine

GC71961

Cevadine

Also known as [(1R,2S,6S,9S,10R,11S,12S,14R,15S,18S,19S,22S,23S,25R)-1,10,11,12,14,23-hexahydroxy-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl] (Z)-2-methylbut-2-enoate

Cevadine is a voltage-sensitive sodium channel agonist

ChemicalCAS62-59-9MW591.73FormulaC32H49NO9
CAS number
62-59-9
Molecular weight
591.73
Formula
C32H49NO9
InChIKey
DBUCFOVFALNEOO-HWBIYQLFSA-N
Catalogue number
GC71961
Brand
GLPBIO
Computed properties PubChem CID 5380394 · XLogP 0.6 · TPSA 160 Ų · H-bond donors 6
XLogP
0.6
TPSA
160 Ų
H-bond donors
6
H-bond acceptors
10
Rotatable bonds
3
Heavy atoms
42

SMILES C/C=C(/C)\C(=O)O[C@H]1CC[C@]2([C@H]3[C@@]1(O[C@@]24C[C@]5([C@@H]6CN7C[C@H](CC[C@H]7[C@@]([C@]6([C@H](C[C@]5([C@@H]4CC3)O)O)O)(C)O)C)O)O)C

Computed descriptors from PubChem (CID 5380394), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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