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A1LXD

Summary
Name:D-2-keto-3-deoxypentonate
Synonyms:(2~{S},4~{S})-2,4-bis(oxidanyl)oxolane-2-carboxylic acid
Formula:C5 H8 O5
Formal charge:0
Formula weight:148.114 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S},4~{S})-2,4-bis(oxidanyl)oxolane-2-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C5H8O5/c6-3-1-5(9,4(7)8)10-2-3/h3,6,9H,1-2H2,(H,7,8)/t3-,5-/m0/s1
InChIKeyInChI1.06DONPUMGGARYEMQ-UCORVYFPSA-N
SMILES_CANONICALCACTVS3.385O[C@@H]1CO[C@@](O)(C1)C(O)=O
SMILESCACTVS3.385O[CH]1CO[C](O)(C1)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C1[C@@H](CO[C@@]1(C(=O)O)O)O
SMILESOpenEye OEToolkits2.0.7C1C(COC1(C(=O)O)O)O

225946

PDB entries from 2024-10-09

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