Molecule

N-Methylhydrastine; (Z)-form

AlkaPlorer ID: AK306138

Synonym: None

IUPAC Name: (3E)-3-[[6-[2-(dimethylamino)ethyl]-1,3-benzodioxol-5-yl]methylidene]-6,7-dimethoxy-2-benzofuran-1-one

Structure

SMILES: COC1=CC=C2/C(=C\C3=CC4=C(C=C3CCN(C)C)OCO4)OC(=O)C2=C1OC

InChI: InChI=1S/C22H23NO6/c1-23(2)8-7-13-9-18-19(28-12-27-18)11-14(13)10-17-15-5-6-16(25-3)21(26-4)20(15)22(24)29-17/h5-6,9-11H,7-8,12H2,1-4H3/b17-10+

InChIKey: WKXVSXLPAVDRQX-LICLKQGHSA-N

Reference

Alkaloids of Fumaria densiflora

PubChem CID: 5839585

CAS: 76202-53-4

LOTUS: LTS0107250

SuperNatural Ⅲ: SN0413073-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Fumaria parviflora	Fumaria	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Fumaria vaillantii	Fumaria	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Fumaria schleicheri	Fumaria	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Corydalis	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Corydalis	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 397.4270000000002

TPSA？: 66.46000000000001

MolLogP？: 3.2051000000000016

Number of H-Donors: 0

Number of H-Acceptors: 7

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi