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1-Deoxy-N-ethyl-1-[6-(ethylamino)-2-[2-(1-hydroxycyclohexyl)ethynyl]-9H-purin-9-yl]-β-D-ribofuranuronamide

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Catalog No. : NC58911

CAS No. :

Product Level :

Brand : NewCan Bio

Molecular Formula : C₂₂H₃₀N₆O₅

Chemical Name : 1-Deoxy-N-ethyl-1-[6-(ethylamino)-2-[2-(1-hydroxycyclohexyl)ethynyl]-9H-purin-9-yl]-β-D-ribofuranuronamide

Molecular Weight : 458.51

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Basic information

Standard English name
Cas No.
Alias	(2S,3S,4R,5R)-N-ethyl-5-(6-(ethylamino)-2-((1-hydroxycyclohexyl)ethynyl)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-carboxamide
Canonical Smiles	CCNC1N=C(C#CC2(O)CCCCC2)N=C2C=1N=CN2[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NCC
MDL No.
Exact Mass	458.22777
Smiles	O[C@H]1[C@H](N2C=NC3=C(NCC)N=C(C#CC4(O)CCCCC4)N=C23)O[C@H](C(NCC)=O)[C@H]1O

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Inchi	InChI=1S/C22H30N6O5/c1-3-23-18-14-19(27-13(26-18)8-11-22(32)9-6-5-7-10-22)28(12-25-14)21-16(30)15(29)17(33-21)20(31)24-4-2/h12,15-17,21,29-30,32H,3-7,9-10H2,1-2H3,(H,24,31)(H,23,26,27)/t15-,16+,17-,21+/m0/s1
InchiKey	MSUZJNFNBRXSAD-GRXQJBFDSA-N
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