FB6

6-(dihydroxyboranyl)-2-methyl-L-norleucine

Created:	2011-06-27
Last modified:	2011-07-13

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1 entries where FB6 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	1
Bond Count	28
Aromatic Bond Count	0

2D diagram of FB6

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Chemical Component Summary
Name	6-(dihydroxyboranyl)-2-methyl-L-norleucine
Systematic Name (OpenEye OEToolkits)	2-azanyl-6-(dihydroxyboranyl)-2-methyl-hexanoic acid
Formula	C₇ H₁₆ B N O₄
Molecular Weight	189.017
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(N)(CCCCB(O)O)C
SMILES	CACTVS	3.370	C[C](N)(CCCCB(O)O)C(O)=O
SMILES	OpenEye OEToolkits	1.7.2	B(CCCCC(C)(C(=O)O)N)(O)O
Canonical SMILES	CACTVS	3.370	C[C@](N)(CCCCB(O)O)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.2	B(CCCCC(C)(C(=O)O)N)(O)O
InChI	InChI	1.03	InChI=1S/C7H16BNO4/c1-7(9,6(10)11)4-2-3-5-8(12)13/h12-13H,2-5,9H2,1H3,(H,10,11)/t7-/m0/s1
InChIKey	InChI	1.03	VJCNFQNUKLFMMR-ZETCQYMHSA-N

Related Resource References

Resource Name	Reference
PubChem	72200564, 53249972

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