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- ChemComp-SRT: S,R MESO-TARTARIC ACID -

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Basic information

EntryDatabase: PDB chemical components / ID: SRT
NameName: S,R meso-tartaric acid

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Chemical information

Composition
Formula: C4H6O6 / Number of atoms: 16 / Formula weight: 150.087 / Formal charge: 0
Others

2c1l

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: SRT / Model coordinates PDB-ID: 2C1L
History
Create componentSep 15, 2005
Modify descriptorJun 4, 2011
External linksUniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DrugBank / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04O=C(O)C(O)C(O)C(=O)O
CACTVS 3.341O[CH]([CH](O)C(O)=O)C(O)=O
OpenEye OEToolkits 1.5.0C(C(C(=O)O)O)(C(=O)O)O

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SMILES CANONICAL

CACTVS 3.341O[C@@H]([C@@H](O)C(O)=O)C(O)=O
OpenEye OEToolkits 1.5.0[C@H]([C@H](C(=O)O)O)(C(=O)O)O

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InChI

InChI 1.03InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2+

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InChIKey

InChI 1.03FEWJPZIEWOKRBE-XIXRPRMCSA-N

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SYSTEMATIC NAME

ACDLabs 10.04(2R,3S)-2,3-dihydroxybutanedioic acid
OpenEye OEToolkits 1.5.0(2S,3R)-2,3-dihydroxybutanedioic acid

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