Mesotal

MediLexicon inositol niacinate - Medical Dictionary Definition for Term 'inositol niacinate'

[1. a peripheral vasodilator.

Molecular Formula: C42H30N6O12


InChI: InChI=1/C42H30N6O12/c49-37(25-7-1-13-43-19-25)55-31-32(56-38(50)26-8-2-14-44-20-26)34(58-40(52)28-10-4-16-46-22-28)36(60-42(54)30-12-6-18-48-24-30)35(59-41(53)29-11-5-17-47-23-29)33(31)57-39(51)27-9-3-15-45-21-27/h1-24,31-36H

InChIKey: InChIKey=MFZCIDXOLLEMOO-UHFFFAOYAP
SMILES: O=C(OC1C(OC(=O)C2=CC=CN=C2)C(OC(=O)C3=CC=CN=C3)C(OC(=O)C4=CC=CN=C4)C(OC(=O)C5=CC=CN=C5)C1OC(=O)C6=CC=CN=C6)C7=CC=CN=C7

CAS number 6556-11-2

Names:
    Dilexpal
    Hamovannad
    hexanicotinoyl inositol
    inositol hexanicotinate
    Inositol niacinate
    inositol niacinate
    Mesotal
    Nicotinic acid, ester, with 1,2-trans, 3-cis, 4-trans, 5-cis, 6-cis-cyclohexanehexol
    NSC49506
    [2,3,4,5,6-pentakis(pyridine-3-carbonyloxy)cyclohexyl] pyridine-3-carboxylate

Registries:
    PubChem CID 3720
    Beilstein =471091
    CAS 6556-11-2 (from NIST)
    ChEBI 33064
    PubChem ID 101633