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SRT : Summary
Code 
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SRT
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One-letter code 
|
X
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Molecule name 
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S,R MESO-TARTARIC ACID
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Systematic names 
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|
Formula 
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C4 H6 O6
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Formal charge 
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0
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Molecular weight 
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150.087 Da
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SMILES 
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Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(O)C(O)C(O)C(=O)O |
SMILES
|
CACTVS |
3.341 |
O[CH]([CH](O)C(O)=O)C(O)=O |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
C(C(C(=O)O)O)(C(=O)O)O |
Canonical SMILES
|
CACTVS |
3.341 |
O[C@@H]([C@@H](O)C(O)=O)C(O)=O |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
[C@H]([C@H](C(=O)O)O)(C(=O)O)O |
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IUPAC InChI  | InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2+ |
IUPAC InChI key  | FEWJPZIEWOKRBE-XIXRPRMCSA-N |
|
wwPDB Information |
Atom count 
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16 (10 without Hydrogen)
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Polymer type 
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Bound ligand
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Type description 
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NON-POLYMER
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Type code 
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HETAIN
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Is modified 
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No
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Standard parent 
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Not Assigned
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Defined at 
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2005-09-15
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Last modified at 
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2011-06-04
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Status 
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Released
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Obsoleted 
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Not Assigned
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