R1X
1,4-anhydro-D-ribitol
Created: | 2008-10-03 |
Last modified: | 2020-07-17 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 19 |
Chiral Atom Count | 3 |
Bond Count | 19 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 1,4-anhydro-D-ribitol |
Synonyms | 1-deoxyribose |
Systematic Name (OpenEye OEToolkits) | (2R,3S,4S)-2-(hydroxymethyl)oxolane-3,4-diol |
Formula | C5 H10 O4 |
Molecular Weight | 134.13 |
Type | D-SACCHARIDE |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OCC1OCC(O)C1O |
SMILES | CACTVS | 3.341 | OC[CH]1OC[CH](O)[CH]1O |
SMILES | OpenEye OEToolkits | 1.5.0 | C1C(C(C(O1)CO)O)O |
Canonical SMILES | CACTVS | 3.341 | OC[C@H]1OC[C@H](O)[C@@H]1O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C1[C@@H]([C@@H]([C@H](O1)CO)O)O |
InChI | InChI | 1.03 | InChI=1S/C5H10O4/c6-1-4-5(8)3(7)2-9-4/h3-8H,1-2H2/t3-,4+,5-/m0/s1 |
InChIKey | InChI | 1.03 | KZVAAIRBJJYZOW-LMVFSUKVSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 10931473 |
CCDC/CSD | HIWPOV |