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RI2 : Summary
Code
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RI2
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One-letter code
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X
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Molecule name
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1,5-di-O-phosphono-alpha-D-ribofuranose
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Synonyms
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1,5-di-O-phosphono-alpha-D-ribose
1,5-di-O-phosphono-D-ribose
1,5-di-O-phosphono-ribose
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Systematic names
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Formula
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C5 H12 O11 P2
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Formal charge
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0
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Molecular weight
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310.09 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
12.01 |
O=P(O)(O)OCC1OC(OP(=O)(O)O)C(O)C1O |
SMILES
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CACTVS |
3.370 |
O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)O[P](O)(O)=O |
SMILES
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OpenEye OEToolkits |
1.7.0 |
C(C1C(C(C(O1)OP(=O)(O)O)O)O)OP(=O)(O)O |
Canonical SMILES
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CACTVS |
3.370 |
O[C@H]1[C@@H](O)[C@H](O[C@@H]1CO[P](O)(O)=O)O[P](O)(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
1.7.0 |
C([C@@H]1[C@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)OP(=O)(O)O |
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IUPAC InChI | InChI=1S/C5H12O11P2/c6-3-2(1-14-17(8,9)10)15-5(4(3)7)16-18(11,12)13/h2-7H,1H2,(H2,8,9,10)(H2,11,12,13)/t2-,3-,4-,5-/m1/s1 |
IUPAC InChI key | AAAFZMYJJHWUPN-TXICZTDVSA-N |
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wwPDB Information |
Atom count
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30 (18 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, alpha 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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RIB
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Defined at
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2011-01-07
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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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