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TT7

Summary
Name:4-O-phosphono-beta-D-fructofuranose
Formula:C6 H13 O9 P
Formal charge:0
Formula weight:260.136 Da
Component type:D-saccharide, beta linking

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-O-phosphono-beta-D-fructofuranose
OpenEye OEToolkits2.0.7[(2~{R},3~{S},4~{S},5~{R})-2,5-bis(hydroxymethyl)-4,5-bis(oxidanyl)oxolan-3-yl] dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01OC1(OC(C(C1O)OP(=O)(O)O)CO)CO
InChIInChI1.03InChI=1S/C6H13O9P/c7-1-3-4(15-16(11,12)13)5(9)6(10,2-8)14-3/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6-/m1/s1
InChIKeyInChI1.03IPJUIZZQMKRPQG-ARQDHWQXSA-N
SMILES_CANONICALCACTVS3.385OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O[P](O)(O)=O
SMILESCACTVS3.385OC[CH]1O[C](O)(CO)[CH](O)[CH]1O[P](O)(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C([C@@H]1[C@H]([C@@H]([C@](O1)(CO)O)O)OP(=O)(O)O)O
SMILESOpenEye OEToolkits2.0.7C(C1C(C(C(O1)(CO)O)O)OP(=O)(O)O)O

218853

PDB entries from 2024-04-24

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