Vitas-M small molecule compound

1,3-dimethyl-7-pentofuranosyl-3,4,5,7-tetrahydro-1H-purine-2,6-dione

Catalog ID
STK031137
SMILES OCC1OC(C(C1O)O)N1C=NC2C1C(=O)N(C)C(=O)N2C

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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 C12H18N4O6 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O6/c1-14-9-6(10(20)15(2)12(14)21)16(4-13-9)11-8(19)7(18)5(3-17)22-11/h4-9,11,17-19H,3H2,1-2H3
InChIKey
BTZHWQIQLAHYIT-UHFFFAOYSA-N
Synonyms

13dimethyl7pentofuranosyl3457tetrahydro1Hpurine26dione
7(34DIHYDROXY5(HYDROXYMETHYL)OXOLAN2YL)13DIMETHYL45DIHYDROPURINE26DIONE
CN1C2C(C(=O)N(C1=O)C)N(C=N2)C3C(C(C(O3)CO)O)O
InChI=1SC12H18N4O6c11496(10(20)15(2)12(14)21)16(4139)118(19)7(18)5(317)2211h49111719H3H212H3
MFCD09959985
OCC1OC(C(C1O)O)N1C=NC2C1C(=O)N(C)C(=O)N2C
STK031137
ZINC000239025569
ZINC000239025572

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.