BTK
N~6~-butanoyl-L-lysine
Created: | 2010-05-18 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 35 |
Chiral Atom Count | 1 |
Bond Count | 34 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | N~6~-butanoyl-L-lysine |
Systematic Name (OpenEye OEToolkits) | (2S)-2-azanyl-6-(butanoylamino)hexanoic acid |
Formula | C10 H20 N2 O3 |
Molecular Weight | 216.277 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(N)CCCCNC(=O)CCC |
SMILES | CACTVS | 3.370 | CCCC(=O)NCCCC[CH](N)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.0 | CCCC(=O)NCCCCC(C(=O)O)N |
Canonical SMILES | CACTVS | 3.370 | CCCC(=O)NCCCC[C@H](N)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | CCCC(=O)NCCCC[C@@H](C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C10H20N2O3/c1-2-5-9(13)12-7-4-3-6-8(11)10(14)15/h8H,2-7,11H2,1H3,(H,12,13)(H,14,15)/t8-/m0/s1 |
InChIKey | InChI | 1.03 | VRWLRMTUPOYQFV-QMMMGPOBSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 49866729 |