Aristolactam IIIa; Me ether 

AlkaPlorer ID: AK099824

Synonym: Aristolactam III

IUPAC Name: 16-methoxy-3,5-dioxa-10-azapentacyclo[9.7.1.02,6.08,19.013,18]nonadeca-1(18),2(6),7,11(19),12,14,16-heptaen-9-one

Structure

SMILES: COC1=CC=C2C=C3N=C(O)C4=CC5=C(OCO5)C(=C34)C2=C1

copy

InChI: InChI=1S/C17H11NO4/c1-20-9-3-2-8-4-12-14-11(17(19)18-12)6-13-16(22-7-21-13)15(14)10(8)5-9/h2-6H,7H2,1H3,(H,18,19)

copy

InChIKey: LUASRNDIAICNKN-UHFFFAOYSA-N

copy

Source

Properties Information

Molecule Weight: 293.278

TPSA: 60.28

MolLogP: 3.6800000000000015

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information