Vitas-M small molecule compound

8-(4-methylpiperidin-1-yl)-9-pentofuranosyl-1,9-dihydro-6H-purin-6-one

Catalog ID
STL510943
SMILES OCC1OC(C(C1O)O)n1c(nc2c1nc[nH]c2=O)N1CCC(CC1)C

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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 C16H23N5O5 MW 365.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N5O5/c1-8-2-4-20(5-3-8)16-19-10-13(17-7-18-14(10)25)21(16)15-12(24)11(23)9(6-22)26-15/h7-9,11-12,15,22-24H,2-6H2,1H3,(H,17,18,25)
InChIKey
UONWPCCRGXTMPY-UHFFFAOYSA-N
Synonyms

135451343
8(4methylpiperidin1yl)9pentofuranosyl19dihydro6Hpurin6one
9((2R3R4S5R)34dihydroxy5(hydroxymethyl)tetrahydrofuran2yl)8(4methylpiperidin1yl)1Hpurin6(9H)one
9(34dihydroxy5(hydroxymethyl)oxolan2yl)8(4methylpiperidin1yl)1~(H)purin6one
9(34DIHYDROXY5(HYDROXYMETHYL)OXOLAN2YL)8(4METHYLPIPERIDIN1YL)3HPURIN6ONE
9(34DIHYDROXY5(HYDROXYMETHYL)OXOLAN2YL)8(4METHYLPIPERIDYL)HYDROPURIN6ONE
InChI=1SC16H23N5O5c182420(538)16191013(1771814(10)25)21(16)1512(24)11(23)9(622)2615h791112152224H26H21H3(H171825)
MFCD01549895
OC(C@H)1O(C@H)((C@@H)((C@@H)1O)O)n1c(nc2c1nc(nH)c2=O)N1CCC(CC1)C
ZINC000012318139
ZINC000247849730

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Available files

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