M7B

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Summary

Name:7-O-phosphono-D-glycero-beta-D-manno-heptopyranose
Synonyms:7-O-phosphono-D-glycero-beta-D-manno-heptose
7-O-phosphono-D-glycero-D-manno-heptose; 7-O-phosphono-D-glycero-manno-heptose
Formula:C7 H15 O10 P
Formal charge:0
Molecular weight:290.162 Da
Component type:D-saccharide, beta linking

Chemical Identifiers

ProgramVersionName
ACDLabs12.017-O-phosphono-D-glycero-beta-D-manno-heptopyranose
OpenEye OEToolkits1.7.6[(2R)-2-oxidanyl-2-[(2R,3S,4S,5S,6R)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]ethyl] dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=P(O)(O)OCC(O)C1OC(O)C(O)C(O)C1O
InChIInChI1.03InChI=1S/C7H15O10P/c8-2(1-16-18(13,14)15)6-4(10)3(9)5(11)7(12)17-6/h2-12H,1H2,(H2,13,14,15)/t2-,3+,4+,5+,6-,7-/m1/s1
InChIKeyInChI1.03SDADNVAZGVDAIM-ZUHYCWGWSA-N
SMILES_CANONICALCACTVS3.370O[C@H](CO[P](O)(O)=O)[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
SMILESCACTVS3.370O[CH](CO[P](O)(O)=O)[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits1.7.6C([C@H]([C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O)O)O)O)O)OP(=O)(O)O
SMILESOpenEye OEToolkits1.7.6C(C(C1C(C(C(C(O1)O)O)O)O)O)OP(=O)(O)O
170172
PDB entries from 2020-10-21