JAZ

6-PHOSPHOCYCLOPHELLITOL

Created:2015-11-24
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count4
Bond Count32
Aromatic Bond Count0
2D diagram of JAZ

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Chemical Component Summary

Name6-PHOSPHOCYCLOPHELLITOL
Systematic Name (OpenEye OEToolkits)[(2R,3S,5S,6R)-2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]methyl dihydrogen phosphate
FormulaC7 H15 O9 P
Molecular Weight274.162
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385O[CH]1[CH](O)[CH](O)[CH](CO[P](O)(O)=O)[CH](O)[CH]1O
SMILESOpenEye OEToolkits1.7.6C(C1C(C(C(C(C1O)O)O)O)O)OP(=O)(O)O
Canonical SMILESCACTVS3.385 O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO[P](O)(O)=O)[C@@H](O)[C@@H]1O
Canonical SMILESOpenEye OEToolkits1.7.6 C(C1[C@H]([C@@H](C([C@H]([C@@H]1O)O)O)O)O)OP(=O)(O)O
InChIInChI1.03 InChI=1S/C7H15O9P/c8-3-2(1-16-17(13,14)15)4(9)6(11)7(12)5(3)10/h2-12H,1H2,(H2,13,14,15)/t2-,3-,4-,5+,6+,7-/m1/s1
InChIKeyInChI1.03 UJSILGAUEGUBGA-NYLBLOMBSA-N