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G16 : Summary
Code
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G16
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One-letter code
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X
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Molecule name
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1,6-di-O-phosphono-alpha-D-glucopyranose
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Synonyms
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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
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Systematic names
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Formula
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C6 H13 O12 P2
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Formal charge
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-1
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Molecular weight
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339.108 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
10.04 |
O=P([O-])(OC1OC(C(O)C(O)C1O)COP(=O)(O)O)O |
SMILES
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CACTVS |
3.341 |
O[CH]1[CH](O)[CH](CO[P](O)(O)=O)O[CH](O[P](O)([O-])=O)[CH]1O |
SMILES
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OpenEye OEToolkits |
1.5.0 |
C(C1C(C(C(C(O1)OP(=O)(O)[O-])O)O)O)OP(=O)(O)O |
Canonical SMILES
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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
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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 |
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IUPAC InChI | 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 |
IUPAC InChI key | RWHOZGRAXYWRNX-VFUOTHLCSA-M |
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wwPDB Information |
Atom count
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33 (20 without Hydrogen)
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Polymer type
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Saccharide
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Type description
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D-saccharide
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Type code
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ATOMS
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Is modified
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Yes
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Standard parent
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GLC
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Defined at
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1999-08-11
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Last modified at
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2020-07-17
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Status
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Released
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Obsoleted
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Not Assigned
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