Chemical Component Summary

Name{(3R)-3-amino-4-[(3-hexylphenyl)amino]-4-oxobutyl}phosphonic acid
Identifiers[(3R)-3-azanyl-4-[(3-hexylphenyl)amino]-4-oxidanylidene-butyl]phosphonic acid
FormulaC16 H27 N2 O4 P
Molecular Weight342.37
TypeNON-POLYMER
Isomeric SMILESCCCCCCc1cccc(c1)NC(=O)[C@@H](CCP(=O)(O)O)N
InChIInChI=1S/C16H27N2O4P/c1-2-3-4-5-7-13-8-6-9-14(12-13)18-16(19)15(17)10-11-23(20,21)22/h6,8-9,12,15H,2-5,7,10-11,17H2,1H3,(H,18,19)(H2,20,21,22)/t15-/m1/s1
InChIKeyFWJRVGZWNDOOFH-OAHLLOKOSA-N

Chemical Details

Formal Charge0
Atom Count50
Chiral Atom Count1
Bond Count50
Aromatic Bond Count6

Related Resource References

Resource NameReference
Pharos CHEMBL1221649
PubChem 6857802, 51892645
ChEMBL CHEMBL1221649