Vitas-M small molecule compound

2-amino-8-(benzylamino)-9-pentofuranosyl-1,9-dihydro-6H-purin-6-one

Catalog ID
STK373388
SMILES OCC1OC(C(C1O)O)n1c(NCc2ccccc2)nc2c1nc(N)[nH]c2=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 C17H20N6O5 MW 388.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N6O5/c18-16-21-13-10(14(27)22-16)20-17(19-6-8-4-2-1-3-5-8)23(13)15-12(26)11(25)9(7-24)28-15/h1-5,9,11-12,15,24-26H,6-7H2,(H,19,20)(H3,18,21,22,27)
InChIKey
NFPWPUKNJIRZPK-UHFFFAOYSA-N
Synonyms
69364-53-0
2amino8(benzylamino)9((2R3R4S5R)34dihydroxy5(hydroxymethyl)tetrahydrofuran2yl)1Hpurin6(9H)one
2AMINO8(BENZYLAMINO)9(34DIHYDROXY5(HYDROXYMETHYL)OXOLAN2YL)3HPURIN6ONE
2AMINO8(BENZYLAMINO)9(34DIHYDROXY5(HYDROXYMETHYL)TETRAHYDRO2FURANYL)19DIHYDRO6HPURIN6ONE
2amino8(benzylamino)9pentofuranosyl19dihydro6Hpurin6one
2AMINO9(34DIHYDROXY5(HYDROXYMETHYL)OXOLAN2YL)8(BENZYLAMINO)HYDROPURIN6ONE
69364530
6HPURIN6ONE9DIHYDRO8((PHENYLMETHYL)AMINO)
C1=CC=C(C=C1)CNC2=NC3=C(N2C4C(C(C(O4)CO)O)O)NC(=NC3=O)N
InChI=1SC17H20N6O5c1816211310(14(27)2216)2017(1968421358)23(13)1512(26)11(25)9(724)2815h1591112152426H67H2(H1920)(H318212227)
MFCD00475669
OC(C@H)1O(C@H)((C@@H)((C@@H)1O)O)n1c(NCc2ccccc2)nc2c1nc(N)(nH)c2=O
OCC1OC(C(C1O)O)n1c(NCc2ccccc2)nc2c1nc(N)(nH)c2=O
ZINC000008740161
ZINC000239164961

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Available files

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