L-4-Chlorotryptophan (CHEBI:170088)

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CHEBI:170088 - L-4-Chlorotryptophan

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ChEBI ID	CHEBI:170088
ChEBI Name	L-4-Chlorotryptophan
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C11H11ClN2O2
Net Charge	0
Average Mass	238.674
Monoisotopic Mass	238.05091
SMILES	NC(Cc1cnc2cccc(Cl)c12)C(=O)O
InChI	InChI=1S/C11H11ClN2O2/c12-7-2-1-3-9-10(7)6(5-14-9)4-8(13)11(15)16/h1-3,5,8,14H,4,13H2,(H,15,16)
InChIKey	NRTHKYABOMUPSC-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)
	HeLa cell;NIH-3T3 cell (BTO:0000944)	MetaboLights (MTBLS78)
	Hepa-RG cell (BTO:0005736)	MetaboLights (MTBLS78)
	HeLa cell (BTO:0000567)	MetaboLights (MTBLS78)
	NIH-3T3 cell (BTO:0000944)	MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090)	Hepa-RG cell (BTO:0005736)	MetaboLights (MTBLS78)	Strain: C57BL/6J [EFO:0000606]

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	L-4-Chlorotryptophan (CHEBI:170088) is a indolyl carboxylic acid (CHEBI:46867)

IUPAC Name
2-amino-3-(4-chloro-1H-indol-3-yl)propanoic acid

Manual Xrefs	Databases
HMDB0030400	HMDB
10498613	ChemSpider