Oxomaritidine

AlkaPlorer ID: AK036952

Synonym: '(+)-Oxomaritidine'

IUPAC Name: (1R,10S)-4,5-dimethoxy-9-azatetracyclo[7.5.2.01,10.02,7]hexadeca-2,4,6,13-tetraen-12-one

Structure

SMILES: COC1=CC2=C(C=C1OC)[C@@]13C=CC(=O)C[C@@H]1N(CC3)C2

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InChI: InChI=1S/C17H19NO3/c1-20-14-7-11-10-18-6-5-17(13(11)9-15(14)21-2)4-3-12(19)8-16(17)18/h3-4,7,9,16H,5-6,8,10H2,1-2H3/t16-,17-/m0/s1

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InChIKey: ZBFKHAADSKNAMY-IRXDYDNUSA-N

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Source

Properties Information

Molecule Weight: 285.3430000000001

TPSA: 38.77

MolLogP: 2.0585

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Trypanosoma brucei rhodesiense Trypanosoma brucei rhodesiense IC50 2.8 ug.mL-1 10.1016/j.bmcl.2019.126642
None NON-PROTEIN TARGET GI50 64000.0 nM 10.1016/j.ejmech.2016.05.004
None NON-PROTEIN TARGET GI50 100000.0 nM 10.1016/j.ejmech.2016.05.004

Metabolism Information