HLX
5-methyl-L-norleucine
Created: | 2013-03-28 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 25 |
Chiral Atom Count | 1 |
Bond Count | 24 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 5-methyl-L-norleucine |
Systematic Name (OpenEye OEToolkits) | (2S)-2-azanyl-5-methyl-hexanoic acid |
Formula | C7 H15 N O2 |
Molecular Weight | 145.199 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(N)CCC(C)C |
SMILES | CACTVS | 3.370 | CC(C)CC[CH](N)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)CCC(C(=O)O)N |
Canonical SMILES | CACTVS | 3.370 | CC(C)CC[C@H](N)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)CC[C@@H](C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C7H15NO2/c1-5(2)3-4-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)/t6-/m0/s1 |
InChIKey | InChI | 1.03 | FMUMEWVNYMUECA-LURJTMIESA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 36689988, 94817 |