IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
N-6-trimethyllysine
Summary
Physicochemical
Drug-likeness
ADME
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPPAT3_PHYID017910
Phytochemical name:
N-6-trimethyllysine
Synonymous chemical names:
N-6-Trimethyllysine
External chemical identifiers:
CID:CID_440120
,
Molport-051-934-444
Chemical structure information
SMILES:
[O-]C(=O)[C@H](CCCC[N+](C)(C)C)N
InChI:
InChI=1S/C9H20N2O2/c1-11(2,3)7-5-4-6-8(10)9(12)13/h8H,4-7,10H2,1-3H3/t8-/m0/s1
InChIKey:
MXNRLFUSFKVQSK-QMMMGPOBSA-N
DeepSMILES:
[O-]C=O)[C@H]CCCC[N+]C)C)C))))))N
Functional groups:
CC(=O)[O-], C[N+](C)(C)C, CN
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Organic acids and derivatives
ClassyFire Class:
Carboxylic acids and derivatives
ClassyFire Subclass:
Amino acids, peptides, and analogues
NP-Likeness score:
0.863
Chemical structure download
2D:
2D MOL
2D MOL2
2D SDF
3D:
3D MOL
3D MOL2
3D SDF
3D PDB
3D PDBQT
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