PRW
Summary
Name: | (2R,3R)-4-AMINO-2,3-DIHYDROXYBUTANOIC ACID |
Formula: | C4 H9 N O4 |
Formal charge: | 0 |
Formula weight: | 135.119 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (2R,3R)-4-amino-2,3-dihydroxybutanoic acid |
OpenEye OEToolkits | 1.6.1 | (2R,3R)-4-amino-2,3-dihydroxy-butanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(O)C(O)CN |
SMILES_CANONICAL | CACTVS | 3.352 | NC[C@@H](O)[C@@H](O)C(O)=O |
SMILES | CACTVS | 3.352 | NC[CH](O)[CH](O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | C([C@H]([C@H](C(=O)O)O)O)N |
SMILES | OpenEye OEToolkits | 1.6.1 | C(C(C(C(=O)O)O)O)N |
InChI | InChI | 1.03 | InChI=1S/C4H9NO4/c5-1-2(6)3(7)4(8)9/h2-3,6-7H,1,5H2,(H,8,9)/t2-,3-/m1/s1 |
InChIKey | InChI | 1.03 | WITVYMTUWTVRND-PWNYCUMCSA-N |