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GPM

Summary
Name:(1S)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol
Synonyms:GLUCOPYRANOSYL-1-METHYL-PHOSPHONIC ACID
Alpha-1 phosphonomethylene-D-glucopyranose
Formula:C7 H15 O8 P
Formal charge:0
Formula weight:258.163 Da
Component type:D-saccharide

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(1S)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol
OpenEye OEToolkits1.7.6[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]methylphosphonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=P(O)(O)CC1OC(C(O)C(O)C1O)CO
InChIInChI1.03InChI=1S/C7H15O8P/c8-1-3-5(9)7(11)6(10)4(15-3)2-16(12,13)14/h3-11H,1-2H2,(H2,12,13,14)/t3-,4-,5-,6+,7+/m1/s1
InChIKeyInChI1.03XRMRHVWWWWFMKR-OVHBTUCOSA-N
SMILES_CANONICALCACTVS3.370OC[C@H]1O[C@H](C[P](O)(O)=O)[C@H](O)[C@@H](O)[C@@H]1O
SMILESCACTVS3.370OC[CH]1O[CH](C[P](O)(O)=O)[CH](O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits1.7.6C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)CP(=O)(O)O)O)O)O)O
SMILESOpenEye OEToolkits1.7.6C(C1C(C(C(C(O1)CP(=O)(O)O)O)O)O)O

246704

PDB entries from 2025-12-24

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