5GM
(4S)-2,4-dimethyl-L-norleucine
Created: | 2015-09-24 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 28 |
Chiral Atom Count | 2 |
Bond Count | 27 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (4S)-2,4-dimethyl-L-norleucine |
Systematic Name (OpenEye OEToolkits) | (2S,4S)-2-azanyl-2,4-dimethyl-hexanoic acid |
Formula | C8 H17 N O2 |
Molecular Weight | 159.226 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NC(C(=O)O)(CC(C)CC)C |
SMILES | CACTVS | 3.385 | CC[CH](C)C[C](C)(N)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.6 | CCC(C)CC(C)(C(=O)O)N |
Canonical SMILES | CACTVS | 3.385 | CC[C@H](C)C[C@](C)(N)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | CC[C@H](C)C[C@@](C)(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C8H17NO2/c1-4-6(2)5-8(3,9)7(10)11/h6H,4-5,9H2,1-3H3,(H,10,11)/t6-,8-/m0/s1 |
InChIKey | InChI | 1.03 | YWAJMILGBXVJTJ-XPUUQOCRSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 57935241 |