GK2

[(2~{R})-1-[(2~{R})-2-azanyl-3-methyl-butanoyl]pyrrolidin-2-yl]boronic acid

Created:	2018-09-19
Last modified:	2024-09-27

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3 entries where GK2 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	2
Bond Count	34
Aromatic Bond Count	0

2D diagram of GK2

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Chemical Component Summary
Name	[(2~{R})-1-[(2~{R})-2-azanyl-3-methyl-butanoyl]pyrrolidin-2-yl]boronic acid
Systematic Name (OpenEye OEToolkits)	[(2~{R})-1-[(2~{R})-2-azanyl-3-methyl-butanoyl]pyrrolidin-2-yl]boronic acid
Formula	C₉ H₁₉ B N₂ O₃
Molecular Weight	214.07
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CC(C)[CH](N)C(=O)N1CCC[CH]1B(O)O
SMILES	OpenEye OEToolkits	2.0.6	B(C1CCCN1C(=O)C(C(C)C)N)(O)O
Canonical SMILES	CACTVS	3.385	CC(C)[C@@H](N)C(=O)N1CCC[C@H]1B(O)O
Canonical SMILES	OpenEye OEToolkits	2.0.6	B([C@@H]1CCCN1C(=O)[C@@H](C(C)C)N)(O)O
InChI	InChI	1.03	InChI=1S/C9H19BN2O3/c1-6(2)8(11)9(13)12-5-3-4-7(12)10(14)15/h6-8,14-15H,3-5,11H2,1-2H3/t7-,8+/m0/s1
InChIKey	InChI	1.03	FKCMADOPPWWGNZ-JGVFFNPUSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL305170
PubChem	9942554
ChEMBL	CHEMBL305170

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