SGB

O-[(S)-METHYL(1-METHYLETHOXY)PHOSPHORYL]-L-SERINE

Created: 2007-02-13
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count30
Chiral Atom Count2
Bond Count29
Aromatic Bond Count0
2D diagram of SGB

Chemical Component Summary

NameO-[(S)-METHYL(1-METHYLETHOXY)PHOSPHORYL]-L-SERINE
Systematic Name (OpenEye OEToolkits)(2S)-2-amino-3-(methyl-propan-2-yloxy-phosphoryl)oxy-propanoic acid
FormulaC7 H16 N O5 P
Molecular Weight225.179
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=P(OCC(N)C(=O)O)(OC(C)C)C
SMILESCACTVS3.341CC(C)O[P](C)(=O)OC[CH](N)C(O)=O
SMILESOpenEye OEToolkits1.5.0CC(C)OP(=O)(C)OCC(C(=O)O)N
Canonical SMILESCACTVS3.341 CC(C)O[P@@](C)(=O)OC[C@H](N)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 CC(C)O[P@](=O)(C)OC[C@@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C7H16NO5P/c1-5(2)13-14(3,11)12-4-6(8)7(9)10/h5-6H,4,8H2,1-3H3,(H,9,10)/t6-,14-/m0/s1
InChIKeyInChI1.03 RQYSKTURKPPJTP-MDAAJZPYSA-N

Related Resource References

Resource NameReference
PubChem 49867646