1-Acetyl-β-carboline-3-carboxylic acid; 1,2-Dicarboxyethylamide

AlkaPlorer ID: AK283025

Synonym: Oldhamiaine A

IUPAC Name: None

Structure

SMILES: CC(=O)C1=C2NC3=CC=CC=C3C2=CC(C(=O)NC(CC(=O)O)C(=O)O)=N1

copy

InChI: InChI=1S/C18H15N3O6/c1-8(22)15-16-10(9-4-2-3-5-11(9)19-16)6-12(20-15)17(25)21-13(18(26)27)7-14(23)24/h2-6,13,19H,7H2,1H3,(H,21,25)(H,23,24)(H,26,27)

copy

InChIKey: DGZBEWJRRXVRHD-UHFFFAOYSA-N

copy

Reference

CAS: 1644611-23-3

Properties Information

Molecule Weight: 369.33300000000014

TPSA: 149.45

MolLogP: 1.5763999999999998

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information