Molecule

Cassaidine

AlkaPlorer ID: AK042655

Synonym: '', 'Cassaidine'

IUPAC Name: None

Structure

SMILES: C[C@H]1/C(=C/C(=O)OCC[NH+](C)C)CC[C@H]2[C@H]1[C@@H](O)C[C@H]1C(C)(C)[C@@H](O)CC[C@]21C

InChI: InChI=1S/C24H41NO4/c1-15-16(13-21(28)29-12-11-25(5)6)7-8-17-22(15)18(26)14-19-23(2,3)20(27)9-10-24(17,19)4/h13,15,17-20,22,26-27H,7-12,14H2,1-6H3/p+1/b16-13+/t15-,17-,18-,19-,20-,22-,24+/m0/s1

InChIKey: JKPVSFQJGXEMSU-CHEGSHICSA-O

Reference

Recherches sur les alcaloïdes d'Erythrophleum. 12e communication. Cassamine et érythrophlamine; fractionnement des alcaloïdes totaux d'Erythrophleum guineense

LOTUS: LTS0051814

SuperNatural Ⅲ: SN0167991-01

NPASS: NPC88173

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Erythrophleum suaveolens	Erythrophleum	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erythrophleum ivorense	Erythrophleum	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erythrophleum guineense	Erythrophleum	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Casimiroa edulis	Casimiroa	Rutaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 408.6030000000002

TPSA？: 71.2

MolLogP？: 1.8308000000000004

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi