Home > Product Catalog > Product category > Nucleoside > Adenosine, 2-ethynyl-2',3'-O-(1-methylethylidene)-, 5'-[[(2S)-2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(methylthio)-1-oxobutyl]sulfamate]

Adenosine, 2-ethynyl-2',3'-O-(1-methylethylidene)-, 5'-[[(2S)-2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(methylthio)-1-oxobutyl]sulfamate]

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Catalog No. : NC110776

CAS No. : 560071-63-8

Product Level :

Brand : NewCan Bio

Molecular Formula : C₂₅H₃₅N₇O₉S₂

Chemical Name : Adenosine, 2-ethynyl-2',3'-O-(1-methylethylidene)-, 5'-[[(2S)-2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(methylthio)-1-oxobutyl]sulfamate]

Molecular Weight : 641.72

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Basic information

Standard English name
Cas No.	560071-63-8
Alias	((3aR,4R,6R,6aR)-6-(6-amino-2-ethynyl-9H-purin-9-yl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methyl ((tert-butoxycarbonyl)-L-methionyl)sulfamate
Canonical Smiles	CC(C)(C)OC(=O)N[C@@H](CCSC)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@@H]2OC(C)(C)O[C@@H]21)N1C=NC2C1=NC(C#C)=NC=2N
MDL No.
Exact Mass	641.19377
Smiles	NC(N=C(C#C)N=C12)=C1N=CN2[C@H](O3)[C@H](O4)[C@H](OC4(C)C)[C@H]3COS(=O)(NC([C@@H](NC(OC(C)(C)C)=O)CCSC)=O)=O

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Inchi	InChI=1S/C25H35N7O9S2/c1-8-15-29-19(26)16-20(30-15)32(12-27-16)22-18-17(39-25(5,6)40-18)14(38-22)11-37-43(35,36)31-21(33)13(9-10-42-7)28-23(34)41-24(2,3)4/h1,12-14,17-18,22H,9-11H2,2-7H3,(H,28,34)(H,31,33)(H2,26,29,30)/t13-,14+,17+,18+,22+/m0/s1
InchiKey	AYWXTJVMZQVBGX-DVQOCAJJSA-N
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