HSX
5-O-phosphono-alpha-D-ribofuranose
Created: | 2009-01-16 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 25 |
Chiral Atom Count | 4 |
Bond Count | 25 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 5-O-phosphono-alpha-D-ribofuranose |
Synonyms | 5-O-phosphono-alpha-D-ribose; 5-O-phosphono-D-ribose; 5-O-phosphono-ribose |
Systematic Name (OpenEye OEToolkits) | [(2R,3S,4R,5S)-3,4,5-trihydroxyoxolan-2-yl]methyl dihydrogen phosphate |
Formula | C5 H11 O8 P |
Molecular Weight | 230.11 |
Type | D-SACCHARIDE, ALPHA LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(O)OCC1OC(O)C(O)C1O |
SMILES | CACTVS | 3.341 | O[CH]1O[CH](CO[P](O)(O)=O)[CH](O)[CH]1O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C1C(C(C(O1)O)O)O)OP(=O)(O)O |
Canonical SMILES | CACTVS | 3.341 | O[C@H]1O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]1O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C([C@@H]1[C@H]([C@H]([C@H](O1)O)O)O)OP(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5+/m1/s1 |
InChIKey | InChI | 1.03 | KTVPXOYAKDPRHY-AIHAYLRMSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 440101 |
ChEMBL | CHEMBL605020 |
ChEBI | CHEBI:18189 |