Molecule

Purpureine

AlkaPlorer ID: AK030048

Synonym: 'Thalicsimidin', '(+)-Purpureine', 'Thalicsimidine'

IUPAC Name: (6aS)-1,2,3,9,10-pentamethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline

Structure

SMILES: COC1=CC2=C(C=C1OC)C1=C(OC)C(OC)=C(OC)C3=C1[C@H](C2)N(C)CC3

InChI: InChI=1S/C22H27NO5/c1-23-8-7-13-18-15(23)9-12-10-16(24-2)17(25-3)11-14(12)19(18)21(27-5)22(28-6)20(13)26-4/h10-11,15H,7-9H2,1-6H3/t15-/m0/s1

InChIKey: KMLPLPOAFAPFFE-HNNXBMFYSA-N

Reference

New Alkaloids from <i>Annona purpurea</i>

PubChem CID: 15726908

LOTUS: LTS0256443

SuperNatural Ⅲ: SN0189582-02

NPASS: NPC109163

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Beaumontia grandiflora	Beaumontia	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Pseudognaphalium viscosum	Pseudognaphalium	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Thalictrum ichangense	Thalictrum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Amanita pantherina	Amanita	Amanitaceae	Agaricales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota
Streptococcus pyogenes	Streptococcus	Streptococcaceae	Lactobacillales	Bacilli	Bacillota	None	Bacteria

Properties Information

Molecule Weight: 385.4600000000002

TPSA？: 49.39000000000001

MolLogP？: 3.4817000000000027

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi