Home > Product Catalog > Product category > Carbohydrate > [3aS,(-)]-2-[[4-O-Aminocarbonyl-2-[methyl[(dimethylamino)acetyl]amino]-2-deoxy-β-D-gulopyranosyl]amino]-1,3aβ,5,6,7,7aα-hexahydro-7β-hydroxy-4H-imidazo[4,5-c]pyridine-4-one

[3aS,(-)]-2-[[4-O-Aminocarbonyl-2-[methyl[(dimethylamino)acetyl]amino]-2-deoxy-β-D-gulopyranosyl]amino]-1,3aβ,5,6,7,7aα-hexahydro-7β-hydroxy-4H-imidazo[4,5-c]pyridine-4-one

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Catalog No. : NC35146

CAS No. : 97816-59-6

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₈H₃₁N₇O₈

Chemical Name : [3aS,(-)]-2-[[4-O-Aminocarbonyl-2-[methyl[(dimethylamino)acetyl]amino]-2-deoxy-β-D-gulopyranosyl]amino]-1,3aβ,5,6,7,7aα-hexahydro-7β-hydroxy-4H-imidazo[4,5-c]pyridine-4-one

Molecular Weight : 473.48

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Basic information

Standard English name
Cas No.	97816-59-6
Alias	(2R,3R,4S,5R,6R)-5-(2-(dimethylamino)-N-methylacetamido)-4-hydroxy-6-(((3aS,7S)-7-hydroxy-4-oxo-3a,4,5,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridin-2-yl)amino)-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl carbamate
Canonical Smiles	CN(C)CC(=O)N(C)[C@H]1[C@H](NC2NC3[C@H](N=2)C(=O)NC[C@@H]3O)O[C@H](CO)[C@H](OC(N)=O)[C@H]1O
MDL No.
Exact Mass	473.22341
Smiles	O=C1[C@](N=C(N[C@H]2[C@H](N(C)C(CN(C)C)=O)[C@@H]([C@H]([C@@H](CO)O2)OC(N)=O)O)N3)([H])C3[C@@H](O)CN1

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Inchi	InChI=1S/C18H31N7O8/c1-24(2)5-9(28)25(3)12-13(29)14(33-17(19)31)8(6-26)32-16(12)23-18-21-10-7(27)4-20-15(30)11(10)22-18/h7-8,10-14,16,26-27,29H,4-6H2,1-3H3,(H2,19,31)(H,20,30)(H2,21,22,23)/t7-,8+,10?,11-,12+,13-,14-,16+/m0/s1
InchiKey	KRLPBBFRVZCDFB-SUKKKXIXSA-N
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History

NC423536

β-D-Ribofuranuronic acid, 1-[6-amino-2-(2-phenylethynyl)-9H-purin-9-yl]-1-deoxy-, methyl ester, 2,3-diacetate