Vitas-M small molecule compound
7-[2-hydroxy-3-(4-nitrophenoxy)propyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl benzoate
Catalog ID
STK834325
SMILES OC(Cn1c(OC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H19N5O8 MW 481.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O8/c1-25-18-17(19(29)24-21(25)31)26(22(23-18)35-20(30)13-5-3-2-4-6-13)11-15(28)12-34-16-9-7-14(8-10-16)27(32)33/h2-10,15,28H,11-12H2,1H3,(H,24,29,31)InChIKey
QFAAKLHXFRMFHA-UHFFFAOYSA-NSynonyms
300835-10-3(7(2HYDROXY3(4NITROPHENOXY)PROPYL)3METHYL26DIOXOPURIN8YL)BENZOATE
300835103
7(2hydroxy3(4nitrophenoxy)propyl)3methyl26dioxo2367tetrahydro1Hpurin8ylbenzoate
CN1C2=C(C(=O)NC1=O)N(C(=N2)OC(=O)C3=CC=CC=C3)CC(COC4=CC=C(C=C4)(N+)(=O)(O))O
InChI=1SC22H19N5O8c1251817(19(29)2421(25)31)26(22(2318)3520(30)135324613)1115(28)1234169714(81016)27(32)33h2101528H1112H21H3(H242931)
MFCD00809881
OC(Cn1c(OC(=O)c2ccccc2)nc2c1c(=O)(nH)c(=O)n2C)COc1ccc(cc1)(N+)(=O)(O)
ZINC000001814537
ZINC000006444880
Check stock
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