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FBP : Summary
Code
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FBP
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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-beta-D-fructofuranose
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Synonyms
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BETA-FRUCTOSE-1,6-DIPHOSPHATE
FRUCTOSE-1,6-BISPHOSPHATE
1,6-di-O-phosphono-beta-D-fructose
1,6-di-O-phosphono-D-fructose
1,6-di-O-phosphono-fructose
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Systematic names
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Formula
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C6 H14 O12 P2
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Formal charge
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0
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Molecular weight
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340.116 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)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O |
SMILES
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CACTVS |
3.341 |
O[CH]1[CH](O)[C](O)(CO[P](O)(O)=O)O[CH]1CO[P](O)(O)=O |
SMILES
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OpenEye OEToolkits |
1.5.0 |
C(C1C(C(C(O1)(COP(=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@@](O)(CO[P](O)(O)=O)O[C@@H]1CO[P](O)(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
1.5.0 |
C([C@@H]1[C@H]([C@@H]([C@](O1)(COP(=O)(O)O)O)O)O)OP(=O)(O)O |
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IUPAC InChI | InChI=1S/C6H14O12P2/c7-4-3(1-16-19(10,11)12)18-6(9,5(4)8)2-17-20(13,14)15/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6-/m1/s1 |
IUPAC InChI key | RNBGYGVWRKECFJ-ARQDHWQXSA-N |
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wwPDB Information |
Atom count
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34 (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, beta linking
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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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FRU
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Defined at
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1999-07-08
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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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