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BioLiP

PDB CCD ID: MIR
Number of entries in BioLiP: 0
Chemical formula: C5 H12 N O6 P
InChI: InChI=1S/C5H12NO6P/c1-2-11-13(9,10)12-3-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)/t4-/m0/s1
InChIKey: ULHXUTHSGPNKSO-BYPYZUCNSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341CCO[P](O)(=O)OC[CH](N)C(O)=O
OpenEye OEToolkits 1.5.0CCO[P@](=O)(O)OC[C@@H](C(=O)O)N
CACTVS 3.341CCO[P@@](O)(=O)OC[C@H](N)C(O)=O
ACDLabs 10.04O=P(OCC)(OCC(N)C(=O)O)O
OpenEye OEToolkits 1.5.0CCOP(=O)(O)OCC(C(=O)O)N
Name:Monoethylphosphorylserine;
O-[(S)-ethoxy(hydroxy)phosphoryl]-L-serine
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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