Molecule

oxonantenine

AlkaPlorer ID: AK003770

Synonym: '', 'Oxonantenine', '1,2-dimethoxy-4,5,6,6a-tetradehydro-9,10-(methylenedioxy)noraprophin-7-one'

IUPAC Name: 18,19-dimethoxy-5,7-dioxa-13-azapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(20),2,4(8),9,12,14,16,18-octaen-11-one

SMILES: COC1=CC2=CC=NC3=C2C(=C1OC)C1=CC2=C(C=C1C3=O)OCO2

InChI: InChI=1S/C19H13NO5/c1-22-14-5-9-3-4-20-17-15(9)16(19(14)23-2)10-6-12-13(25-8-24-12)7-11(10)18(17)21/h3-7H,8H2,1-2H3

InChIKey: NFDVJYPMLVMXRR-UHFFFAOYSA-N

PubChem CID: 3084224

CAS: 15358-38-0

LOTUS: LTS0142070

SuperNatural Ⅲ: SN0243822

COCONUT: CNP0239041

data_source: manually

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Annona glabra	Annona	Annonaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 335.3150000000001

TPSA？: 66.88000000000001

MolLogP？: 3.192100000000001

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 5

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Electrophorus electricus	Acetylcholinesterase	IC50	150000.0	nM	10.1021/np100247r