Molecule

16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹?.0?,?.0¹?,²?]henicosa-1(21),2,4(8),9,11,15,17,19-octaene

AlkaPlorer ID: AK091912

Synonym: None

IUPAC Name: 16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,11,15(20),16,18-octaene

SMILES: COC1=CC=C2C=C3C4=CC5=C(C=C4C=CN3CC2=C1OC)OCO5

InChI: InChI=1S/C20H17NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-9H,10-11H2,1-2H3

InChIKey: QISXPYZVZJBNDM-UHFFFAOYSA-N

PubChem CID: 162999195

LOTUS: LTS0038697

NPASS: NPC21402

COCONUT: CNP0272808

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Calocephalus knappii	Calocephalus	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Scrippsiella trochoidea	Scrippsiella	Peridiniaceae	Peridiniales	Dinophyceae	None	None	Eukaryota
Androsace septentrionalis	Androsace	Primulaceae	Ericales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Theobroma speciosum	Theobroma	Malvaceae	Malvales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 335.3590000000001

TPSA？: 40.16

MolLogP？: 3.730500000000003

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 5

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi