Molecule

Convolvine

AlkaPlorer ID: AK292945

Synonym: 8-Azabicyclo[3.2.1]oct-3-yl 3,4-dimethoxybenzoate, Veratroylnortropine, 3α-Veratroyloxynortropane, 3α-(3,4-Dimethoxybenzoyloxy)nortropane

IUPAC Name: 8-azabicyclo[3.2.1]octan-3-yl 3,4-dimethoxybenzoate

Structure

SMILES: COC1=CC=C(C(=O)OC2CC3CCC(C2)N3)C=C1OC

InChI: InChI=1S/C16H21NO4/c1-19-14-6-3-10(7-15(14)20-2)16(18)21-13-8-11-4-5-12(9-13)17-11/h3,6-7,11-13,17H,4-5,8-9H2,1-2H3

InChIKey: HDLNHIIKSUHARQ-UHFFFAOYSA-N

Reference

Tropane alkaloids of two species of plants of theConvolvulus genus

PubChem CID: 279064

CAS: 537-30-4

LOTUS: LTS0152179

COCONUT: CNP0349209.3

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Convolvulus subhirsutus	Convolvulus	Convolvulaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Convolvulus erinaceus	Convolvulus	Convolvulaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Evolvulus sericeus	Evolvulus	Convolvulaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Convolvulus lineatus	Convolvulus	Convolvulaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Convolvulus pseudocantabricus	Convolvulus	Convolvulaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 291.34700000000004

TPSA？: 56.790000000000006

MolLogP？: 2.1436

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi