Molecule

Trimethyllysine

AlkaPlorer ID: AK275792

Synonym: None

IUPAC Name: [(5S)-5-amino-5-carboxypentyl]-trimethylazanium

Structure

SMILES: C[N+](C)(C)CCCC[C@H](N)C(=O)O

InChI: InChI=1S/C9H20N2O2/c1-11(2,3)7-5-4-6-8(10)9(12)13/h8H,4-7,10H2,1-3H3/p+1/t8-/m0/s1

InChIKey: MXNRLFUSFKVQSK-QMMMGPOBSA-O

Reference

A community-driven global reconstruction of human metabolism

PubChem CID: 175910877

CAS: 66989-56-8

LOTUS: LTS0174680

SuperNatural Ⅲ: SN0238071-01

NPASS: NPC278209

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Dipteryx alata	Dipteryx	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Annona foetida	Annona	Annonaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Desmostachya bipinnata	Desmostachya	Poaceae	Poales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Lambertella corni-maris	Lambertella	Rutstroemiaceae	Helotiales	Leotiomycetes	Ascomycota	Fungi	Eukaryota
Saccharina japonica	Saccharina	Laminariaceae	Laminariales	Phaeophyceae	None	None	Eukaryota
Conyza filaginoides	Conyza	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Spodoptera frugiperda	Spodoptera	Noctuidae	Lepidoptera	Insecta	Arthropoda	Metazoa	Eukaryota
Onychium japonicum	Onychium	Pteridaceae	Polypodiales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota
Homo sapiens	Homo	Hominidae	Primates	Mammalia	Chordata	Metazoa	Eukaryota
Primula spectabilis	Primula	Primulaceae	Ericales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Mus musculus	Mus	Muridae	Rodentia	Mammalia	Chordata	Metazoa	Eukaryota
Senecio mairetianus	Senecio	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Tubifera dimorphotheca	Tubifera	Reticulariaceae	Liceales	Eumycetozoa	Evosea	None	Eukaryota
Gossypium barbadense	Gossypium	Malvaceae	Malvales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Campanula persicifolia	Campanula	Campanulaceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Lactuca virosa	Lactuca	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Lamium amplexicaule	Lamium	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 189.279

TPSA？: 63.32000000000001

MolLogP？: 0.2748000000000006

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 0

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Bacillus subtilis	Bacillus subtilis	MIC	5000000.0	nM	10.1038/nchembio842
Homo sapiens	Solute carrier family 22 member 5	Activity	69.0	%	None
None	Nucleic Acid	INH	19.0	Miller_unit	10.1038/nchembio842
None	Nucleic Acid	Kd	1000000.0	nM	10.1038/nchembio842

Metabolism Information

AKRT ID	Reaction	Reaction Link ID
AKRT014306	C[N+](C)(C)CCCC[C@H](N)C(=O)O>>C[N+](C)(C)CCCC(O)[C@H](N)C(=O)O	TRIMETHYLLYSINE-DIOXYGENASE-RXN
AKRT014307	C[N+](C)(C)CCCC[C@H](N)C(=O)O>>C[N+](C)(C)CCC[C@H](O)[C@H](N)C(=O)O	R03451
AKRT014587	C[SAH].C[SAH].C[SAH].NCCCC[C@H](N)C(=O)O>>C[N+](C)(C)CCCC[C@H](N)C(=O)O	MNXR163012