Vitas-M small molecule compound

6-hydroxy-7-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-methyl-8-(morpholin-4-yl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STK640876
SMILES OC(c1ccc(cc1)[N+](=O)[O-])Cn1c(nc2c1c(O)nc(=O)n2C)N1CCOCC1

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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 C18H20N6O6 MW 416.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O6/c1-21-15-14(16(26)20-18(21)27)23(17(19-15)22-6-8-30-9-7-22)10-13(25)11-2-4-12(5-3-11)24(28)29/h2-5,13,25H,6-10H2,1H3,(H,20,26,27)
InChIKey
SOZIUADCJTVTAX-UHFFFAOYSA-N
Synonyms

6hydroxy7(2hydroxy2(4nitrophenyl)ethyl)3methyl8(morpholin4yl)37dihydro2Hpurin2one
7(2HYDROXY2(4NITROPHENYL)ETHYL)3METHYL8MORPHOLIN4YLPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCOCC3)CC(C4=CC=C(C=C4)(N+)(=O)(O))O
InChI=1SC18H20N6O6c1211514(16(26)2018(21)27)23(17(1915)2268309722)1013(25)112412(5311)24(28)29h251325H610H21H3(H202627)
MFCD18162480
OC(c1ccc(cc1)(N+)(=O)(O))Cn1c(nc2c1c(O)nc(=O)n2C)N1CCOCC1
ZINC000008926127

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Available files

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