Home > Product Catalog > Product category > Carbohydrate > 5-[[(2S,3S,4S)-2-Amino-4-hydroxy-4-(4-hydroxyphenyl)-3-methyl-1-oxobutyl]amino]-1-(1,2,3,4-tetrahydro-2,4-dioxopyrimidine-1-yl)-1,5-dideoxy-β-D-allofuranuronic acid

5-[[(2S,3S,4S)-2-Amino-4-hydroxy-4-(4-hydroxyphenyl)-3-methyl-1-oxobutyl]amino]-1-(1,2,3,4-tetrahydro-2,4-dioxopyrimidine-1-yl)-1,5-dideoxy-β-D-allofuranuronic acid

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Catalog No. : NC32859

CAS No. : 74342-20-4

Product Level :

Brand : NewCan Bio

Molecular Formula : C₂₁H₂₆N₄O₁₀

Chemical Name : 5-[[(2S,3S,4S)-2-Amino-4-hydroxy-4-(4-hydroxyphenyl)-3-methyl-1-oxobutyl]amino]-1-(1,2,3,4-tetrahydro-2,4-dioxopyrimidine-1-yl)-1,5-dideoxy-β-D-allofuranuronic acid

Molecular Weight : 494.45

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Basic information

Standard English name
Cas No.	74342-20-4
Alias	(S)-2-((2S,3S,4S)-2-amino-4-hydroxy-4-(4-hydroxyphenyl)-3-methylbutanamido)-2-((2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)acetic acid
Canonical Smiles	C[C@@H]([C@H](N)C(=O)N[C@@H]([C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=O)NC1=O)C(O)=O)[C@H](O)C1C=CC(O)=CC=1
MDL No.
Exact Mass	494.16490
Smiles	O[C@H]1[C@H](N(C(N2)=O)C=CC2=O)O[C@H]([C@H](NC([C@@H](N)[C@H](C)[C@H](O)C3=CC=C(O)C=C3)=O)C(O)=O)[C@H]1O

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Inchi	InChI=1S/C21H26N4O10/c1-8(14(28)9-2-4-10(26)5-3-9)12(22)18(31)24-13(20(32)33)17-15(29)16(30)19(35-17)25-7-6-11(27)23-21(25)34/h2-8,12-17,19,26,28-30H,22H2,1H3,(H,24,31)(H,32,33)(H,23,27,34)/t8-,12-,13-,14-,15-,16+,17+,19+/m0/s1
InchiKey	LQZKMASBFQOGJR-CPBZILATSA-N
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History

NC391995

2-Chloro-N-cyclopentyl-5'-S-(2-fluorophenyl)-2'-C-methyl-5'-thioadenosine