CKP

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Summary

Name:(2R,3R,4S,5R)-2,3,4-TRIHYDROXY-5-[(PHOSPHONATOOXY)METHYL]TETRAHYDROFURAN-2-CARBOXYLIC ACID
Synonyms:2-KETO-6-PHOSPHATE-D-GLUCONIC ACID, ALPHA-FURANOSE FORM
Formula:C6 H11 O10 P
Formal charge:0
Molecular weight:274.119 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.046-O-phosphono-beta-D-psicofuranosonic acid
OpenEye OEToolkits1.5.0(2R,3R,4S,5R)-2,3,4-trihydroxy-5-(phosphonooxymethyl)oxolane-2-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C6H11O10P/c7-3-2(1-15-17(12,13)14)16-6(11,4(3)8)5(9)10/h2-4,7-8,11H,1H2,(H,9,10)(H2,12,13,14)/t2-,3-,4-,6-/m1/s1
InChIKeyInChI1.03LXQWHMQOSMCJIZ-ZGEUXELVSA-N
SMILES_CANONICALCACTVS3.385O[C@H]1[C@@H](O)[C@@](O)(O[C@@H]1CO[P](O)(O)=O)C(O)=O
SMILESCACTVS3.385O[CH]1[CH](O)[C](O)(O[CH]1CO[P](O)(O)=O)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.6C([C@@H]1[C@H]([C@H]([C@@](O1)(C(=O)O)O)O)O)OP(=O)(O)O
SMILESOpenEye OEToolkits2.0.6C(C1C(C(C(O1)(C(=O)O)O)O)O)OP(=O)(O)O