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[1. a peripheral vasodilator.
pre_formula_key( "InChIKey=MFZCIDXOLLEMOO-UHFFFAOYAP", "jqp072/3720.html" ); ?>
pre_formula( "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", "jqp072/3720.html" ); ?>
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
name_it( "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", "jqp072/3720.html" ); ?>
Registries:
pre_registry_key( "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=MFZCIDXOLLEMOO-UHFFFAOYAP", "jqp072/3720.html" ); ?>
PubChem CID 3720
Beilstein =471091
CAS 6556-11-2 (from NIST)
ChEBI 33064
PubChem ID 101633
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require_once( "../ads.include" ); ?>
pre_related( "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", "jqp072/3720.html" ); ?>