Molecule

[3-[(2-amino-2-oxoethyl)carbamoyl]-5-[(2-bromobenzoyl)amino]-6-(2-chloroethylcarbamoyloxy)cyclohex-3-en-1-yl] N-(2-chloroethyl)carbamate

AlkaPlorer ID: AK575733

Synonym: None

IUPAC Name: [3-[(2-amino-2-oxoethyl)carbamoyl]-5-[(2-bromobenzoyl)amino]-6-(2-chloroethylcarbamoyloxy)cyclohex-3-en-1-yl] N-(2-chloroethyl)carbamate

Structure

SMILES: NC(=O)CNC(=O)C1=CC(NC(=O)C2=CC=CC=C2Br)C(OC(=O)NCCCl)C(OC(=O)NCCCl)C1

InChI: InChI=1S/C22H26BrCl2N5O7/c23-14-4-2-1-3-13(14)20(33)30-15-9-12(19(32)29-11-17(26)31)10-16(36-21(34)27-7-5-24)18(15)37-22(35)28-8-6-25/h1-4,9,15-16,18H,5-8,10-11H2,(H2,26,31)(H,27,34)(H,28,35)(H,29,32)(H,30,33)

InChIKey: XWSCDROSVFUIRX-UHFFFAOYSA-N

Reference

The indole alkaloid meleagrin, from the olive tree endophytic fungus Penicillium chrysogenum, as a novel lead for the control of c-Met-dependent breast cancer proliferation, migration and invasion

PubChem CID: 3672390

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain

Properties Information

Molecule Weight: 623.2879999999999

TPSA？: 177.95

MolLogP？: 1.1462999999999994

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi