Molecule

(6Z)-6-({6-[2-(dimethylamino)ethyl]-2H-1,3-benzodioxol-5-yl}methylidene)-2H,7H-[1,3]dioxolo[4,5-e]isoindol-8-one

AlkaPlorer ID: AK325278

Synonym: None

IUPAC Name: (6Z)-6-[[6-[2-(dimethylamino)ethyl]-1,3-benzodioxol-5-yl]methylidene]-[1,3]dioxolo[4,5-g]isoindol-8-one

Structure

SMILES: CN(C)CCC1=CC2=C(C=C1/C=C1\N=C(O)C3=C4OCOC4=CC=C13)OCO2

InChI: InChI=1S/C21H20N2O5/c1-23(2)6-5-12-8-17-18(27-10-26-17)9-13(12)7-15-14-3-4-16-20(28-11-25-16)19(14)21(24)22-15/h3-4,7-9H,5-6,10-11H2,1-2H3,(H,22,24)/b15-7-

InChIKey: ZURFNKDWDFKHSG-CHHVJCJISA-N

Reference

Alkaloidal constituents of Fumaria indica

PubChem CID: 15161648

LOTUS: LTS0029636

SuperNatural Ⅲ: SN0480734-02

NPASS: NPC72140

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Bursatella leachii	Bursatella	Aplysiidae	Aplysiida	Gastropoda	Mollusca	Metazoa	Eukaryota
Chaetomium cochliodes	Chaetomium	Chaetomiaceae	Sordariales	Sordariomycetes	Ascomycota	Fungi	Eukaryota
Sabia schumanniana	Sabia	Sabiaceae	Proteales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Kopsia arborea	Kopsia	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 380.4000000000002

TPSA？: 72.75000000000001

MolLogP？: 3.064400000000001

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi