LA2

N~6~-[(6R)-6,8-disulfanyloctanoyl]-L-lysine

Created:	2008-04-16
Last modified:	2024-09-27

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7 entries where LA2 is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	49
Chiral Atom Count	2
Bond Count	48
Aromatic Bond Count	0

2D diagram of LA2

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Chemical Component Summary
Name	N~6~-[(6R)-6,8-disulfanyloctanoyl]-L-lysine
Synonyms	lipoyllysine
Systematic Name (OpenEye OEToolkits)	(2S)-2-amino-6-[[(6R)-6,8-bis-sulfanyloctanoyl]amino]hexanoic acid
Formula	C₁₄ H₂₈ N₂ O₃ S₂
Molecular Weight	336.514
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)C(N)CCCCNC(=O)CCCCC(S)CCS
SMILES	CACTVS	3.341	N[CH](CCCCNC(=O)CCCC[CH](S)CCS)C(O)=O
SMILES	OpenEye OEToolkits	1.5.0	C(CCC(=O)NCCCCC(C(=O)O)N)CC(CCS)S
Canonical SMILES	CACTVS	3.341	N[C@@H](CCCCNC(=O)CCCC[C@@H](S)CCS)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C(CCC(=O)NCCCC[C@@H](C(=O)O)N)C[C@H](CCS)S
InChI	InChI	1.03	InChI=1S/C14H28N2O3S2/c15-12(14(18)19)6-3-4-9-16-13(17)7-2-1-5-11(21)8-10-20/h11-12,20-21H,1-10,15H2,(H,16,17)(H,18,19)/t11-,12+/m1/s1
InChIKey	InChI	1.03	AYZPHCCEYJWVJC-NEPJUHHUSA-N

Related Resource References

Resource Name	Reference
PubChem	49867224

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