Vitas-M small molecule compound

8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]adenosine

Catalog ID
STK065536
SMILES OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1ncnc2N

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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 C17H18N8O6 MW 430.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N8O6/c18-14-11-15(20-7-19-14)24(16-13(28)12(27)10(6-26)31-16)17(22-11)23-21-5-8-1-3-9(4-2-8)25(29)30/h1-5,7,10,12-13,16,26-28H,6H2,(H,22,23)(H2,18,19,20)/b21-5+/t10-,12-,13-,16-/m1/s1
InChIKey
VGDHNEMIDQJOIQ-KFFALWPESA-N
Synonyms
913260-79-4
(2R3R4S5R)2(6amino8((2E)2((4nitrophenyl)methylidene)hydrazinyl)purin9yl)5(hydroxymethyl)oxolane34diol
(2R3R4S5R)2(6amino8((E)2(4nitrobenzylidene)hydrazinyl)9Hpurin9yl)5(hydroxymethyl)tetrahydrofuran34diol
8((2E)2(4NITROBENZYLIDENE)HYDRAZINYL)ADENOSINE
913260794
C1=CC(=CC=C1C=NNC2=NC3=C(N2C4C(C(C(O4)CO)O)O)N=CN=C3N)(N+)(=O)(O)
InChI=1SC17H18N8O6c18141115(2071914)24(1613(28)12(27)10(626)3116)17(2211)232158139(428)25(29)30h157101213162628H6H2(H2223)(H2181920)b215+t10121316m1s1
MFCD08051734
OC(C@H)1O(C@H)((C@@H)((C@@H)1O)O)n1c(NN=Cc2ccc(cc2)(N+)(=O)(O))nc2c1ncnc2N
STK065536
ZINC000009554187
ZINC96482649

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Available files

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