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N-[9-(2-Deoxy-4-C-ethenyl-2-fluoro-β-Darabinofuranosyl)-6-(dimethylamino)-9H-purin-2-yl]-2-methylpropanamide

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Catalog No. : NC17439

CAS No. : 2171103-96-9

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₈H₂₅FN₆O₄

Chemical Name : N-[9-(2-Deoxy-4-C-ethenyl-2-fluoro-β-Darabinofuranosyl)-6-(dimethylamino)-9H-purin-2-yl]-2-methylpropanamide

Molecular Weight : 408.43

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Basic information

Standard English name
Cas No.	2171103-96-9
Alias	N-(6-(dimethylamino)-9-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-5-vinyltetrahydrofuran-2-yl)-9H-purin-2-yl)isobutyramide
Canonical Smiles	CN(C)C1N=C(NC(=O)C(C)C)N=C2C=1N=CN2[C@@H]1O[C@@](CO)(C=C)[C@@H](O)[C@@H]1F
MDL No.
Exact Mass	408.19213
Smiles	CC(C)C(NC1=NC(N(C)C)=C2N=CN([C@H]3[C@@H](F)[C@@H]([C@](CO)(C=C)O3)O)C2=N1)=O

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Inchi	InChI=1S/C18H25FN6O4/c1-6-18(7-26)12(27)10(19)16(29-18)25-8-20-11-13(24(4)5)21-17(22-14(11)25)23-15(28)9(2)3/h6,8-10,12,16,26-27H,1,7H2,2-5H3,(H,21,22,23,28)/t10-,12-,16+,18+/m0/s1
InchiKey	RFRLZJHXFDABKB-HKXICLBPSA-N
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