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Chemical structure of Nicomol

GC75013

Nicomol

Also known as [2-hydroxy-1,3,3-tris(pyridine-3-carbonyloxymethyl)cyclohexyl]methyl pyridine-3-carboxylate

Nicomol is an orally active hypolipidemic agent that can increase the high density lipoprotein cholesterol (HDL-C) level

ChemicalCAS27959-26-8MW640.64FormulaC34H32N4O9
CAS number
27959-26-8
Molecular weight
640.64
Formula
C34H32N4O9
Solubility
DMSO： 12·5 mg/mL (19·51 mM; ultrasonic and warming and heat to 60°C)
InChIKey
VRAHPESAMYMDQI-UHFFFAOYSA-N
Catalogue number
GC75013
Brand
GLPBIO
Computed properties PubChem CID 34081 · XLogP 2.8 · TPSA 177 Ų · H-bond donors 1
XLogP
2.8
TPSA
177 Ų
H-bond donors
1
H-bond acceptors
13
Rotatable bonds
16
Heavy atoms
47

SMILES C1CC(C(C(C1)(COC(=O)C2=CN=CC=C2)COC(=O)C3=CN=CC=C3)O)(COC(=O)C4=CN=CC=C4)COC(=O)C5=CN=CC=C5

Computed descriptors from PubChem (CID 34081), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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