BUM

2-AMINO-N,3,3-TRIMETHYLBUTANAMIDE

Created:	2001-08-10
Last modified:	2011-06-04

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1 entries where BUM is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	1
Bond Count	25
Aromatic Bond Count	0

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Chemical Component Summary
Name	2-AMINO-N,3,3-TRIMETHYLBUTANAMIDE
Systematic Name (OpenEye OEToolkits)	(2S)-2-amino-N,3,3-trimethyl-butanamide
Formula	C₇ H₁₆ N₂ O
Molecular Weight	144.215
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(NC)C(N)C(C)(C)C
SMILES	CACTVS	3.341	CNC(=O)[CH](N)C(C)(C)C
SMILES	OpenEye OEToolkits	1.5.0	CC(C)(C)C(C(=O)NC)N
Canonical SMILES	CACTVS	3.341	CNC(=O)[C@@H](N)C(C)(C)C
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC(C)(C)[C@@H](C(=O)NC)N
InChI	InChI	1.03	InChI=1S/C7H16N2O/c1-7(2,3)5(8)6(10)9-4/h5H,8H2,1-4H3,(H,9,10)/t5-/m1/s1
InChIKey	InChI	1.03	BPKJNEIOHOEWLO-RXMQYKEDSA-N

Drug Info: DrugBank

DrugBank ID	DB01949
Name	2-Amino-N,3,3-Trimethylbutanamide
Groups	experimental
Synonyms	2-Amino-N,3,3-Trimethylbutanamide

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Matrix metalloproteinase-9	MSLWQPLVLVLLVLGCCFAAPRQRQSTLVLFPGDLRTNLTDRQLAEEYLY...	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