Molecule

Quinolactacin A1; 3-Epimer

AlkaPlorer ID: AK312165

Synonym: Quinolactacin A2, Quinolactacin A (obsol.)

IUPAC Name: 3-butan-2-yl-4-methyl-2,3-dihydropyrrolo[3,4-b]quinoline-1,9-dione

SMILES: CCC(C)C1N=C(O)C2=C1N(C)C1=CC=CC=C1C2=O

InChI: InChI=1S/C16H18N2O2/c1-4-9(2)13-14-12(16(20)17-13)15(19)10-7-5-6-8-11(10)18(14)3/h5-9,13H,4H2,1-3H3,(H,17,20)

InChIKey: FLHQAMWKNPOTDV-UHFFFAOYSA-N

PubChem CID: 10221089

CAS: 386211-69-4

LOTUS: LTS0255001

COCONUT: CNP0186650.4

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NPAtlas: NPA015318

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Penicillium oxalicum	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Penicillium citrinum	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Penicillium sp.	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Penicillium spathulatum	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota

Molecule Weight: 270.332

TPSA？: 54.59

MolLogP？: 2.943900000000001

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 3

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi