2JN
2-methyl-D-norleucine
Created: | 2013-11-01 |
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 | 2-methyl-D-norleucine |
Systematic Name (OpenEye OEToolkits) | (2R)-2-azanyl-2-methyl-hexanoic acid |
Formula | C7 H15 N O2 |
Molecular Weight | 145.199 |
Type | D-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(N)(CCCC)C |
SMILES | CACTVS | 3.385 | CCCC[C](C)(N)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.6 | CCCCC(C)(C(=O)O)N |
Canonical SMILES | CACTVS | 3.385 | CCCC[C@@](C)(N)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | CCCC[C@](C)(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C7H15NO2/c1-3-4-5-7(2,8)6(9)10/h3-5,8H2,1-2H3,(H,9,10)/t7-/m1/s1 |
InChIKey | InChI | 1.03 | LKZQHZQXROBVOO-SSDOTTSWSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 10510975 |