NGH

N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID

Created:	2003-08-06
Last modified:	2011-06-04

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10 entries where NGH is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	41
Chiral Atom Count	1
Bond Count	41
Aromatic Bond Count	6

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Chemical Component Summary
Name	N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID
Systematic Name (OpenEye OEToolkits)	N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]ethanamide
Formula	C₁₃ H₂₀ N₂ O₅ S
Molecular Weight	316.373
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(NO)CN(S(=O)(=O)c1ccc(OC)cc1)CC(C)C
SMILES	CACTVS	3.341	COc1ccc(cc1)[S](=O)(=O)N(CC(C)C)CC(=O)NO
SMILES	OpenEye OEToolkits	1.5.0	CC(C)CN(CC(=O)NO)S(=O)(=O)c1ccc(cc1)OC
Canonical SMILES	CACTVS	3.341	COc1ccc(cc1)[S](=O)(=O)N(CC(C)C)CC(=O)NO
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC(C)C[N@](CC(=O)NO)S(=O)(=O)c1ccc(cc1)OC
InChI	InChI	1.03	InChI=1S/C13H20N2O5S/c1-10(2)8-15(9-13(16)14-17)21(18,19)12-6-4-11(20-3)5-7-12/h4-7,10,17H,8-9H2,1-3H3,(H,14,16)
InChIKey	InChI	1.03	JIRXORZYIXSWOB-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08271
Name	N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID
Groups	experimental
Synonyms	N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID

Drug Targets

Name	Target Sequence	Pharmacological Action
Stromelysin-2	MMHLAFLVLLCLPVCSAYPLSGAAKEEDSNKDLAQQYLEKYYNLEKDVKQ...	unknown
Macrophage metalloelastase	MKFLLILLLQATASGALPLNSSTSLEKNNVLFGERYLEKFYGLEINKLPV...	unknown
Stromelysin-1	MKSLPILLLLCVAVCSAYPLDGAARGEDTSMNLVQKYLENYYDLKKDVKQ...	unknown
Matrix metalloproteinase-20	MKVLPASGLAVFLIMALKFSTAAPSLVAASPRTWRNNYRLAQAYLDKYYT...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682