MP8

(4R)-4-methyl-L-proline

Created: 2009-08-18
Last modified:  2024-09-27

Find related ligands:

Chemical Details

Formal Charge0
Atom Count20
Chiral Atom Count2
Bond Count20
Aromatic Bond Count0
2D diagram of MP8

Chemical Component Summary

Name(4R)-4-methyl-L-proline
Systematic Name (OpenEye OEToolkits)(2S,4R)-4-methylpyrrolidine-2-carboxylic acid
FormulaC6 H11 N O2
Molecular Weight129.157
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(O)C1NCC(C)C1
SMILESCACTVS3.370C[CH]1CN[CH](C1)C(O)=O
SMILESOpenEye OEToolkits1.7.0CC1CC(NC1)C(=O)O
Canonical SMILESCACTVS3.370 C[C@H]1CN[C@@H](C1)C(O)=O
Canonical SMILESOpenEye OEToolkits1.7.0 C[C@@H]1C[C@H](NC1)C(=O)O
InChIInChI1.03 InChI=1S/C6H11NO2/c1-4-2-5(6(8)9)7-3-4/h4-5,7H,2-3H2,1H3,(H,8,9)/t4-,5+/m1/s1
InChIKeyInChI1.03 KKJQZEWNZXRJFG-UHNVWZDZSA-N

Related Resource References

Resource NameReference
PubChem 21632416, 13419856