Home > Product Catalog > Product category > Nucleoside > 1-[2-Deoxy-5-O-[[[(3-hydroxy-2,2-dimethyl-1-oxopropyl)thio]methoxy][(phenylmethyl)amino]phosphinyl]-β-L-erythro-pentofuranosyl]-5-methyl-2,4(1H,3H)-pyrimidinedione

1-[2-Deoxy-5-O-[[[(3-hydroxy-2,2-dimethyl-1-oxopropyl)thio]methoxy][(phenylmethyl)amino]phosphinyl]-β-L-erythro-pentofuranosyl]-5-methyl-2,4(1H,3H)-pyrimidinedione

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Catalog No. : NC418769

CAS No. : 1037072-17-5

Product Level :

Brand : NewCan Bio

Molecular Formula : C₂₃H₃₂N₃O₉PS

Chemical Name : 1-[2-Deoxy-5-O-[[[(3-hydroxy-2,2-dimethyl-1-oxopropyl)thio]methoxy][(phenylmethyl)amino]phosphinyl]-β-L-erythro-pentofuranosyl]-5-methyl-2,4(1H,3H)-pyrimidinedione

Molecular Weight : 557.55

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Basic information

Standard English name
Cas No.	1037072-17-5
Alias	S-((((benzylamino)(((2S,3R,5S)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl)methoxy)phosphoryl)oxy)methyl) 3-hydroxy-2,2-dimethylpropanethioate
Canonical Smiles	CC1=CN([C@@H]2C[C@@H](O)[C@H](COP(=O)(NCC3=CC=CC=C3)OCSC(=O)C(C)(C)CO)O2)C(=O)NC1=O
MDL No.
Exact Mass	557.15969
Smiles	O=C1NC(C(C)=CN1[C@@H]2C[C@H]([C@H](COP(NCC3=CC=CC=C3)(OCSC(C(C)(C)CO)=O)=O)O2)O)=O

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Inchi	InChI=1S/C23H32N3O9PS/c1-15-11-26(22(31)25-20(15)29)19-9-17(28)18(35-19)12-33-36(32,24-10-16-7-5-4-6-8-16)34-14-37-21(30)23(2,3)13-27/h4-8,11,17-19,27-28H,9-10,12-14H2,1-3H3,(H,24,32)(H,25,29,31)/t17-,18+,19+,36?/m1/s1
InchiKey	CMSOCTWMTSWWHQ-PWXFODAJSA-N
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