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OPE

Summary
Name:PHOSPHORIC ACID MONO-(2-AMINO-ETHYL) ESTER
Synonyms:COLAMINE PHOSPHORIC ACID
Formula:C2 H8 N O4 P
Formal charge:0
Formula weight:141.063 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-aminoethyl dihydrogen phosphate
OpenEye OEToolkits1.5.02-aminoethyl dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=P(O)(O)OCCN
SMILES_CANONICALCACTVS3.341NCCO[P](O)(O)=O
SMILESCACTVS3.341NCCO[P](O)(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C(COP(=O)(O)O)N
SMILESOpenEye OEToolkits1.5.0C(COP(=O)(O)O)N
InChIInChI1.03InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6)
InChIKeyInChI1.03SUHOOTKUPISOBE-UHFFFAOYSA-N

217705

PDB entries from 2024-03-27

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