Home > Product Catalog > Product category > Nucleoside > 9-[3-Deoxy-4-C -(difluoromethyl)-3-fluoro-5-O -(2-sulfido-4H -1,3,2-benzodioxaphosphorin-2-yl)-β-D-xylofuranosyl]-9H -purin-6-amine

9-[3-Deoxy-4-C -(difluoromethyl)-3-fluoro-5-O -(2-sulfido-4H -1,3,2-benzodioxaphosphorin-2-yl)-β-D-xylofuranosyl]-9H -purin-6-amine

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Catalog No. : NC16794

CAS No. : 1803135-62-7

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₈H₁₇F₃N₅O₅PS

Chemical Name : 9-[3-Deoxy-4-C -(difluoromethyl)-3-fluoro-5-O -(2-sulfido-4H -1,3,2-benzodioxaphosphorin-2-yl)-β-D-xylofuranosyl]-9H -purin-6-amine

Molecular Weight : 503.39

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Standard English name
Cas No.	1803135-62-7
Alias	2-(((2R,3R,4S,5R)-5-(6-amino-9H-purin-9-yl)-2-(difluoromethyl)-3-fluoro-4-hydroxytetrahydrofuran-2-yl)methoxy)-4H-benzo[d][1,3,2]dioxaphosphinine 2-sulfide
Canonical Smiles	NC1N=CN=C2C=1N=CN2[C@@H]1O[C@](COP2(=S)OC3=CC=CC=C3CO2)([C@H](F)[C@H]1O)C(F)F
MDL No.
Exact Mass	503.06401
Smiles	NC1=C2N=CN([C@H]3[C@@H]([C@@H](F)[C@](COP4(OC5=CC=CC=C5CO4)=S)(C(F)F)O3)O)C2=NC=N1

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Inchi	InChI=1S/C18H17F3N5O5PS/c19-13-12(27)16(26-8-25-11-14(22)23-7-24-15(11)26)30-18(13,17(20)21)6-29-32(33)28-5-9-3-1-2-4-10(9)31-32/h1-4,7-8,12-13,16-17,27H,5-6H2,(H2,22,23,24)/t12-,13-,16-,18-,32?/m1/s1
InchiKey	PCFSPMNTSXIGBT-WKGUPZOYSA-N
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