Home > Product Catalog > All > D-threo-α-D-allo-Octofuranuronic acid, 6-O-[3-amino-N-[(1S)-3-[[(2R)-2-amino-2-carboxyethyl]thio]-1-carboxypropyl]-3,4-dideoxy-β-D-xylo-hexopyranuronamidosyl]-5-[(aminocarbonyl)amino]-3,7-anhydro-1,5-dideoxy-1-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-

D-threo-α-D-allo-Octofuranuronic acid, 6-O-[3-amino-N-[(1S)-3-[[(2R)-2-amino-2-carboxyethyl]thio]-1-carboxypropyl]-3,4-dideoxy-β-D-xylo-hexopyranuronamidosyl]-5-[(aminocarbonyl)amino]-3,7-anhydro-1,5-dideoxy-1-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-

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Catalog No. : NC30791

CAS No. : 58002-06-5

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Molecular Formula : C₂₆H₃₇N₇O₁₆S

Chemical Name : D-threo-α-D-allo-Octofuranuronic acid, 6-O-[3-amino-N-[(1S)-3-[[(2R)-2-amino-2-carboxyethyl]thio]-1-carboxypropyl]-3,4-dideoxy-β-D-xylo-hexopyranuronamidosyl]-5-[(aminocarbonyl)amino]-3,7-anhydro-1,5-dideoxy-1-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-

Molecular Weight : 735.67

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Basic information

Standard English name
Cas No.	58002-06-5
Alias	D-threo-α-D-allo-Octofuranuronic acid, 6-O-[3-amino-N-[(1S)-3-[[(2R)-2-amino-2-carboxyethyl]thio]-1-carboxypropyl]-3,4-dideoxy-β-D-xylo-hexopyranuronamidosyl]-5-[(aminocarbonyl)amino]-3,7-anhydro-1,5-dideoxy-1-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-
Canonical Smiles	NC(=O)NC1C(OC2OC(CC(N)C2O)C(=O)NC(CCSCC(N)C(O)=O)C(O)=O)C(OC2C1OC(C2O)C1=CNC(=O)NC1=O)C(O)=O
MDL No.
Exact Mass	735.20175
Smiles	O=C(O)C1OC2C(O)C(OC2C(NC(=O)N)C1OC3OC(C(=O)NC(C(=O)O)CCSCC(N)C(=O)O)CC(N)C3O)C4=CNC(=O)NC4=O

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Inchi	InChI=1S/C26H37N7O16S/c27-7-3-10(20(37)31-9(22(40)41)1-2-50-5-8(28)21(38)39)46-24(12(7)34)49-16-11(32-25(29)44)15-17(48-18(16)23(42)43)13(35)14(47-15)6-4-30-26(45)33-19(6)36/h4,7-18,24,34-35H,1-3,5,27-28H2,(H,31,37)(H,38,39)(H,40,41)(H,42,43)(H3,29,32,44)(H2,30,33,36,45)
InchiKey	QBZZPXYWRVYWOT-UHFFFAOYSA-N
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