Molecule

UNPD80919

AlkaPlorer ID: AK460888

Synonym: None

IUPAC Name: methyl 2-(6'-ethenyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl)-3-methoxyprop-2-enoate

Structure

SMILES: C=CC1CN2CCC3(C(O)=NC4=CC=CC=C43)C2CC1C(=COC)C(=O)OC

InChI: InChI=1S/C22H26N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h4-8,13-15,19H,1,9-12H2,2-3H3,(H,23,26)

InChIKey: MUVGVMUWMAGNSY-UHFFFAOYSA-N

Reference

Alkaloids from the Leaves of <i>Uncaria rhynchophylla</i> and Their Inhibitory Activity on NO Production in Lipopolysaccharide-Activated Microglia

PubChem CID: 73081505

CAS: 630-94-4

LOTUS: LTS0034184

COCONUT: CNP0169915.13

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Mitragyna rotundifolia	Mitragyna	Rubiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 382.46000000000015

TPSA？: 71.36

MolLogP？: 3.125700000000002

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi