mansouramycin A (CHEBI:177359)

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ChEBI Name	mansouramycin A

ChEBI ID	CHEBI:177359

Definition	A member of the class of isoquinolines that is 5,8-dihydroisoquinoline substituted by methyl, methyl, oxo, methylamino and oxo groups at positions 3, 4, 5, 7 and 8, respectively. It was isolated from Streptomyces Sp. strain Mei37 from North Sea coast, Germany.

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

Supplier Information

Download	Molfile XML SDF

Formula

C12H12N2O2

Net Charge

Average Mass

216.240

Monoisotopic Mass

216.08988

InChI

InChI=1S/C12H12N2O2/c1-6-7(2)14-5-8-11(6)10(15)4-9(13-3)12(8)16/h4-5,13H,1-3H3

InChIKey

SDLNCVBYFYLESJ-UHFFFAOYSA-N

SMILES

CNC1=CC(=O)C2=C(C=NC(C)=C2C)C1=O

Metabolite of Species	Details
Streptomyces sp. (NCBI:txid1931)	of strain Mei37 See: PubMed
Streptomyces albus J1074 (NCBI:txid457425)	produced via heterologously introduced biosynthetic gene cluster in a bacterial host. See: PubMed

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms. antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria.

ChEBI Ontology
Outgoing	mansouramycin A (CHEBI:177359) has role antibacterial agent (CHEBI:33282) mansouramycin A (CHEBI:177359) has role bacterial metabolite (CHEBI:76969) mansouramycin A (CHEBI:177359) has role marine metabolite (CHEBI:76507) mansouramycin A (CHEBI:177359) is a p-quinones (CHEBI:25830) mansouramycin A (CHEBI:177359) is a isoquinolines (CHEBI:24922) mansouramycin A (CHEBI:177359) is a secondary amino compound (CHEBI:50995)

IUPAC Name

3,4-dimethyl-7-(methylamino)isoquinoline-5,8-dione

Synonym	Source
7-methylamino-3,4-dimethylisoquinoline-5,8-dione	ChEBI

Registry Number	Type	Source
1199808-44-0	CAS Registry Number	KNApSAcK

Last Modified

10 August 2021