Home > Product Catalog > All > β-D-erythro-Hex-2-enopyranuronic acid, 4-[[(3S)-5-[(aminoiminomethyl)methylamino]-3-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-1-oxopentyl]amino]-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy- (9CI)

β-D-erythro-Hex-2-enopyranuronic acid, 4-[[(3S)-5-[(aminoiminomethyl)methylamino]-3-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-1-oxopentyl]amino]-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy- (9CI)

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Catalog No. : NC25133

CAS No. : 19018-47-4

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Molecular Formula : C₂₃H₃₇N₉O₆

Chemical Name : β-D-erythro-Hex-2-enopyranuronic acid, 4-[[(3S)-5-[(aminoiminomethyl)methylamino]-3-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-1-oxopentyl]amino]-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy- (9CI)

Molecular Weight : 535.60

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Basic information

Standard English name
Cas No.	19018-47-4
Alias	β-D-erythro-Hex-2-enopyranuronic acid, 4-[[(3S)-5-[(aminoiminomethyl)methylamino]-3-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-1-oxopentyl]amino]-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy- (9CI)
Canonical Smiles	CN(CCC(CC(=O)NC1C=CC(OC1C(O)=O)N1C=CC(N)=NC1=O)NC(=O)C(N)CC(C)C)C(N)=N
MDL No.
Exact Mass	535.28668
Smiles	O=C1N=C(N)C=CN1C2OC(C(=O)O)C(C=C2)NC(=O)CC(NC(=O)C(N)CC(C)C)CCN(C(=N)N)C

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Inchi	InChI=1S/C23H37N9O6/c1-12(2)10-14(24)20(34)28-13(6-8-31(3)22(26)27)11-17(33)29-15-4-5-18(38-19(15)21(35)36)32-9-7-16(25)30-23(32)37/h4-5,7,9,12-15,18-19H,6,8,10-11,24H2,1-3H3,(H3,26,27)(H,28,34)(H,29,33)(H,35,36)(H2,25,30,37)
InchiKey	CMEAFYGYVWZYDO-UHFFFAOYSA-N
Remark