(-)-chuangxinmycin (CHEBI:79391)

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ChEBI Name	(−)-chuangxinmycin

ChEBI ID	CHEBI:79391

ChEBI ASCII Name	(-)-chuangxinmycin

Definition	A thiinoindole that is 3,5-dihydro-2H-thiino[4,3,2-cd]indole which is substituted at positions 2 and 3 by carboxy and methyl groups, respectively (the 2R,3S diastereoisomer).

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C12H11NO2S

Net Charge

Average Mass

233.28600

Monoisotopic Mass

233.05105

InChI

InChI=1S/C12H11NO2S/c1-6-7-5-13-8-3-2-4-9(10(7)8)16-11(6)12(14)15/h2-6,11,13H,1H3,(H,14,15)/t6-,11+/m0/s1

InChIKey

DKHFLDXCKWDVMF-UPONEAKYSA-N

SMILES

C[C@@H]1[C@@H](Sc2cccc3[nH]cc1c23)C(O)=O

Metabolite of Species	Details
Actinoplanes tsinanensis (NCBI:txid2039464)	See: PubMed

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	EC 6.1.1.2 (tryptophan--tRNA ligase) inhibitor An EC 6.1.1.* (ligases forming aminoacyl tRNA and related compounds) inhibitor that interferes with the action of any tryptophantRNA ligase (EC 6.1.1.2). antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via alkaloid )

ChEBI Ontology
Outgoing	(−)-chuangxinmycin (CHEBI:79391) has role antibacterial agent (CHEBI:33282) (−)-chuangxinmycin (CHEBI:79391) has role antimicrobial agent (CHEBI:33281) (−)-chuangxinmycin (CHEBI:79391) has role bacterial metabolite (CHEBI:76969) (−)-chuangxinmycin (CHEBI:79391) has role EC 6.1.1.2 (tryptophan—tRNA ligase) inhibitor (CHEBI:79392) (−)-chuangxinmycin (CHEBI:79391) is a indole alkaloid (CHEBI:38958) (−)-chuangxinmycin (CHEBI:79391) is a monocarboxylic acid (CHEBI:25384) (−)-chuangxinmycin (CHEBI:79391) is a thiinoindole (CHEBI:79393)

IUPAC Name

(2R,3S)-3-methyl-3,5-dihydro-2H-thiino[4,3,2-cd]indole-2-carboxylic acid

Synonyms	Sources
(−)-(4S,5R)-chuangxinmycin	ChEBI
(−)-chuangxinmycin	ChEBI
(4S,5R)-(−)-chuangxinmycin	ChEBI
chuanghsinmycin	ChemIDplus
chuangxinmycin	ChemIDplus
cis-(−)-3,5-dihydro-3-methyl-2H-thiopyrano(4,3,2-cd)indole-2-carboxylic acid	ChemIDplus

Last Modified

17 August 2023