G16

1,6-di-O-phosphono-alpha-D-glucopyranose

Created:	1999-08-11
Last modified:	2024-09-27

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16 entries where G16 is found as a standalone ligand1 entries where G16 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	-1
Atom Count	33
Chiral Atom Count	5
Bond Count	33
Aromatic Bond Count	0

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Chemical Component Summary
Name	1,6-di-O-phosphono-alpha-D-glucopyranose
Synonyms	ALPHA-D-GLUCOSE 1,6-BISPHOSPHATE; 1,6-di-O-phosphono-alpha-D-glucose; 1,6-di-O-phosphono-D-glucose; 1,6-di-O-phosphono-glucose
Systematic Name (OpenEye OEToolkits)	[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl] hydrogen phosphate
Formula	C₆ H₁₃ O₁₂ P₂
Molecular Weight	339.108
Type	D-SACCHARIDE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=P([O-])(OC1OC(C(O)C(O)C1O)COP(=O)(O)O)O
SMILES	CACTVS	3.341	O[CH]1[CH](O)[CH](CO[P](O)(O)=O)O[CH](O[P](O)([O-])=O)[CH]1O
SMILES	OpenEye OEToolkits	1.5.0	C(C1C(C(C(C(O1)OP(=O)(O)[O-])O)O)O)OP(=O)(O)O
Canonical SMILES	CACTVS	3.341	O[C@H]1[C@H](O)[C@@H](CO[P](O)(O)=O)O[C@H](O[P](O)([O-])=O)[C@@H]1O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[P@](=O)(O)[O-])O)O)O)OP(=O)(O)O
InChI	InChI	1.03	InChI=1S/C6H14O12P2/c7-3-2(1-16-19(10,11)12)17-6(5(9)4(3)8)18-20(13,14)15/h2-9H,1H2,(H2,10,11,12)(H2,13,14,15)/p-1/t2-,3-,4+,5-,6-/m1/s1
InChIKey	InChI	1.03	RWHOZGRAXYWRNX-VFUOTHLCSA-M

Drug Info: DrugBank

DrugBank ID	DB02835
Name	Alpha-D-Glucose 1,6-Bisphosphate
Groups	experimental
Synonyms	Alpha-D-Glucose 1,6-Bisphosphate
CAS number	10139-18-1

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Beta-phosphoglucomutase	MFKAVLFDLDGVITDTAEYHFRAWKALAEEIGINGVDRQFNEQLKGVSRE...	unknown
Phosphoglucomutase-1	MVKIVTVKTQAYQDQKPGTSGLRKRVKVFQSSANYAENFIQSIISTVEPA...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682