CAS 152-72-7 appears in our catalog under these names: Acenocoumarol, 95%, Acenocoumarol, Acenocoumarol, >95% (HPLC), Acenocoumarol, 98%, Acenocoumarol/ 98.6% (existing batch purity). Offered by: Combi-blocks, Chemat Brand, TRC, AmBeed, Mikromol. Available pack sizes: 250mg, 1g, on request, 10mg, 25mg, 50mg, 5mg, 10mM (in 1ml dmso).
Acenocoumarol is a hydroxycoumarin that is warfarin in which the hydrogen at position 4 of the phenyl substituent is replaced by a nitro group. It has a role as an anticoagulant and an EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor. It is a C-nitro compound, a hydroxycoumarin and a methyl ketone.
Source: ChEBI
| Molecular formula | C19H15NO6 |
|---|---|
| Molecular weight | 353.3 g/mol |
| IUPAC name | 4-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]chromen-2-one |
| InChIKey | VABCILAOYCMVPS-UHFFFAOYSA-N |
| SMILES | CC(=O)CC(C1=CC=C(C=C1)[N+](=O)[O-])C2=C(C3=CC=CC=C3OC2=O)O |
Computed by PubChem (NCBI)