2-Amino-3-(3-bromo-5-chloro-4-hydroxyphenyl)propanoic acid; (S)-form 

AlkaPlorer ID: AK284390

Synonym: L-form 

IUPAC Name: 2-amino-3-(3-bromo-5-chloro-4-hydroxyphenyl)propanoic acid

Structure

SMILES: NC(CC1=CC(Cl)=C(O)C(Br)=C1)C(=O)O

copy

InChI: InChI=1S/C9H9BrClNO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)

copy

InChIKey: HSTYVQDTQIZATD-UHFFFAOYSA-N

copy

Reference

PubChem CID: 21773342

COCONUT: CNP0261508.1

Properties Information

Molecule Weight: 294.53200000000004

TPSA: 83.55

MolLogP: 1.7625

Number of H-Donors: 3

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information