Molecule

Plakoridine A

AlkaPlorer ID: AK045953

Synonym: '', '155944-28-8'

IUPAC Name: methyl (2S,3S,4R,5E)-4-hydroxy-1-[2-(4-hydroxyphenyl)ethyl]-5-(2-oxooctadecylidene)-2-propylpyrrolidine-3-carboxylate

Structure

SMILES: CCCCCCCCCCCCCCCCC(=O)/C=C1\[C@H](O)[C@@H](C(=O)OC)[C@H](CCC)N1CCC1=CC=C(O)C=C1

InChI: InChI=1S/C35H57NO5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-20-30(38)27-32-34(39)33(35(40)41-3)31(19-5-2)36(32)26-25-28-21-23-29(37)24-22-28/h21-24,27,31,33-34,37,39H,4-20,25-26H2,1-3H3/b32-27+/t31-,33-,34-/m0/s1

InChIKey: ULFKEEJTLUNSEY-CWJJWNJISA-N

Reference

Studies on the Constituents of Broussonetia Species. I. Two New Pyrrolidine Alkaloids, Broussonetines C and D, as .BETA.-Galactosidase and .BETA.-Mannosidase Inhibitors from Broussonetia kazinoki SIEB.

PubChem CID: 10257462

LOTUS: LTS0168879

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Broussonetia kazinoki	Broussonetia	Moraceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 571.8430000000003

TPSA？: 87.07

MolLogP？: 7.893500000000011

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi