Vitas-M small molecule compound

8-{(2E)-2-[4-(benzyloxy)-3-methoxybenzylidene]hydrazinyl}adenosine

Catalog ID
STK082660
SMILES OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1c(N/N=C/c2ccc(c(c2)OC)OCc2ccccc2)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 C25H27N7O6 MW 521.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N7O6/c1-36-17-9-15(7-8-16(17)37-12-14-5-3-2-4-6-14)10-29-31-25-30-19-22(26)27-13-28-23(19)32(25)24-21(35)20(34)18(11-33)38-24/h2-10,13,18,20-21,24,33-35H,11-12H2,1H3,(H,30,31)(H2,26,27,28)/b29-10+/t18-,20-,21-,24-/m1/s1
InChIKey
DKTLXRGFGHOKLO-XRHBFBKZSA-N
Synonyms
956278-27-6
(2R3R4S5R)2(6amino8((2E)2((3methoxy4phenylmethoxyphenyl)methylidene)hydrazinyl)purin9yl)5(hydroxymethyl)oxolane34diol
(2R3R4S5R)2(6amino8((E)2(4(benzyloxy)3methoxybenzylidene)hydrazinyl)9Hpurin9yl)5(hydroxymethyl)tetrahydrofuran34diol
8((2E)2(4(BENZYLOXY)3METHOXYBENZYLIDENE)HYDRAZINYL)ADENOSINE
COC1=C(C=CC(=C1)C=NNC2=NC3=C(N2C4C(C(C(O4)CO)O)O)N=CN=C3N)OCC5=CC=CC=C5
InChI=1SC25H27N7O6c13617915(7816(17)3712145324614)10293125301922(26)27132823(19)32(25)2421(35)20(34)18(1133)3824h21013182021243335H1112H21H3(H3031)(H2262728)b2910+t18202124m1s1
MFCD08671021
OC(C@H)1O(C@H)((C@@H)((C@@H)1O)O)n1c(NN=Cc2ccc(c(c2)OC)OCc2ccccc2)nc2c1ncnc2N
STK082660
ZINC101484263

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Available files

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