B0D

(2R,3S,4R,5R,6R)-2,6-difluoro-2-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol

Created:	2009-08-18
Last modified:	2020-07-17

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2 entries where B0D is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	23
Chiral Atom Count	5
Bond Count	23
Aromatic Bond Count	0

2D diagram of B0D

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Chemical Component Summary
Name	(2R,3S,4R,5R,6R)-2,6-difluoro-2-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
Systematic Name (OpenEye OEToolkits)	(2R,3S,4R,5R,6R)-2,6-difluoro-2-(hydroxymethyl)oxane-3,4,5-triol
Formula	C₆ H₁₀ F₂ O₅
Molecular Weight	200.137
Type	L-SACCHARIDE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	11.02	FC1OC(F)(C(O)C(O)C1O)CO
SMILES	CACTVS	3.352	OC[C]1(F)O[CH](F)[CH](O)[CH](O)[CH]1O
SMILES	OpenEye OEToolkits	1.7.0	C(C1(C(C(C(C(O1)F)O)O)O)F)O
Canonical SMILES	CACTVS	3.352	OC[C@]1(F)O[C@H](F)[C@H](O)[C@@H](O)[C@@H]1O
Canonical SMILES	OpenEye OEToolkits	1.7.0	C([C@]1([C@H]([C@@H]([C@H]([C@H](O1)F)O)O)O)F)O
InChI	InChI	1.03	InChI=1S/C6H10F2O5/c7-5-3(11)2(10)4(12)6(8,1-9)13-5/h2-5,9-12H,1H2/t2-,3-,4+,5+,6+/m1/s1
InChIKey	InChI	1.03	MGHYRMVVRYCAON-PQMKYFCFSA-N

Related Resource References

Resource Name	Reference
PubChem	44241503

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