Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

A1LXB

Summary
Name:L-2,4-diketo-3-deoxyfuconate
Synonyms:(2~{S},5~{S})-5-methyl-2-oxidanyl-4-oxidanylidene-oxolane-2-carboxylic acid
Formula:C6 H8 O5
Formal charge:0
Formula weight:160.125 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S},5~{S})-5-methyl-2-oxidanyl-4-oxidanylidene-oxolane-2-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C6H8O5/c1-3-4(7)2-6(10,11-3)5(8)9/h3,10H,2H2,1H3,(H,8,9)/t3-,6-/m0/s1
InChIKeyInChI1.06RVGZVGXMALCWOM-DZSWIPIPSA-N
SMILES_CANONICALCACTVS3.385C[C@@H]1O[C@@](O)(CC1=O)C(O)=O
SMILESCACTVS3.385C[CH]1O[C](O)(CC1=O)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C[C@H]1C(=O)C[C@](O1)(C(=O)O)O
SMILESOpenEye OEToolkits2.0.7CC1C(=O)CC(O1)(C(=O)O)O

223166

건을2024-07-31부터공개중

PDB statisticsPDBj update infoContact PDBjnumon