ASJ
(3S)-3-amino-4-hydroxybutanoic acid
Created: | 2010-10-07 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 17 |
Chiral Atom Count | 1 |
Bond Count | 16 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (3S)-3-amino-4-hydroxybutanoic acid |
Systematic Name (OpenEye OEToolkits) | (3S)-3-azanyl-4-hydroxy-butanoic acid |
Formula | C4 H9 N O3 |
Molecular Weight | 119.119 |
Type | PEPTIDE-LIKE |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CC(N)CO |
SMILES | CACTVS | 3.370 | N[CH](CO)CC(O)=O |
SMILES | OpenEye OEToolkits | 1.7.0 | C(C(CO)N)C(=O)O |
Canonical SMILES | CACTVS | 3.370 | N[C@H](CO)CC(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | C([C@@H](CO)N)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C4H9NO3/c5-3(2-6)1-4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | BUZICZZQJDLXJN-VKHMYHEASA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 1502045, 7122912 |