BIL

(3R,4S)-3-amino-4-methylhexanoic acid

Created:	2008-02-05
Last modified:	2024-09-27

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16 entries where BIL is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	2
Bond Count	24
Aromatic Bond Count	0

2D diagram of BIL

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Chemical Component Summary
Name	(3R,4S)-3-amino-4-methylhexanoic acid
Synonyms	(R,S)-beta-3-homoisoleucine
Systematic Name (OpenEye OEToolkits)	(3R,4S)-3-amino-4-methyl-hexanoic acid
Formula	C₇ H₁₅ N O₂
Molecular Weight	145.2
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)CC(N)C(CC)C
SMILES	CACTVS	3.341	CC[CH](C)[CH](N)CC(O)=O
SMILES	OpenEye OEToolkits	1.5.0	CCC(C)C(CC(=O)O)N
Canonical SMILES	CACTVS	3.341	CC[C@H](C)[C@H](N)CC(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC[C@H](C)[C@@H](CC(=O)O)N
InChI	InChI	1.03	InChI=1S/C7H15NO2/c1-3-5(2)6(8)4-7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)/t5-,6+/m0/s1
InChIKey	InChI	1.03	JHEDYGILOIBOTL-NTSWFWBYSA-N

Related Resource References

Resource Name	Reference
PubChem	40475756, 16211048

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