L2O
(2S,3R)-3-amino-2-hydroxy-5-methylhexanoic acid
Created: | 2010-10-09 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 26 |
Chiral Atom Count | 2 |
Bond Count | 25 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2S,3R)-3-amino-2-hydroxy-5-methylhexanoic acid |
Systematic Name (OpenEye OEToolkits) | (2S,3R)-3-azanyl-2-hydroxy-5-methyl-hexanoic acid |
Formula | C7 H15 N O3 |
Molecular Weight | 161.199 |
Type | PEPTIDE-LIKE |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(O)C(N)CC(C)C |
SMILES | CACTVS | 3.370 | CC(C)C[CH](N)[CH](O)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)CC(C(C(=O)O)O)N |
Canonical SMILES | CACTVS | 3.370 | CC(C)C[C@@H](N)[C@H](O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)C[C@H]([C@@H](C(=O)O)O)N |
InChI | InChI | 1.03 | InChI=1S/C7H15NO3/c1-4(2)3-5(8)6(9)7(10)11/h4-6,9H,3,8H2,1-2H3,(H,10,11)/t5-,6+/m1/s1 |
InChIKey | InChI | 1.03 | GZLMFCWSEKVVGO-RITPCOANSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 12879197 |