TEO
Summary
Name: | MALATE LIKE INTERMEDIATE |
Formula: | C4 H4 O5 |
Formal charge: | -2 |
Formula weight: | 132.072 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (2R,3Z)-2,4-dihydroxy-4-oxidobut-3-enoate |
OpenEye OEToolkits | 1.5.0 | (Z,2R)-2,4-dihydroxy-4-oxido-but-3-enoate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | [O-]/C(O)=C/C(O)C([O-])=O |
InChI | InChI | 1.03 | InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h1-2,5-7H,(H,8,9)/p-2/t2-/m1/s1 |
InChIKey | InChI | 1.03 | QFBHYOKSQPPXHZ-UWTATZPHSA-L |
SMILES_CANONICAL | CACTVS | 3.385 | O[C@H](\C=C(O)\[O-])C([O-])=O |
SMILES | CACTVS | 3.385 | O[CH](C=C(O)[O-])C([O-])=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.5 | C(=C(\O)/[O-])\[C@H](C(=O)[O-])O |
SMILES | OpenEye OEToolkits | 1.7.5 | C(=C(O)[O-])C(C(=O)[O-])O |