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CHEBI:91949 - [(2S)-3-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-hydroxypropyl]-(phenylmethyl)phosphinic acid

ChEBI IDCHEBI:91949
ChEBI Name[(2S)-3-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-hydroxypropyl]-(phenylmethyl)phosphinic acid
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FormulaC18H22Cl2NO3P
Net Charge0
Average Mass402.258
Monoisotopic Mass401.07144
SMILESC[C@H](NC[C@H](O)CP(=O)(O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C18H22Cl2NO3P/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14/h2-9,13,16,21-22H,10-12H2,1H3,(H,23,24)/t13-,16-/m0/s1
InChIKeyZODSPDOOCZZEIM-BBRMVZONSA-N
ChEBI Ontology
Outgoing Relation(s)
[(2S)-3-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-hydroxypropyl]-(phenylmethyl)phosphinic acid (CHEBI:91949) is a dichlorobenzene (CHEBI:23697)
Manual XrefsDatabases
LSM-1892LINCS