293
2-deoxy-beta-L-galacto-heptopyranose
Created: | 2007-11-09 |
Last modified: | 2020-07-17 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 27 |
Chiral Atom Count | 5 |
Bond Count | 27 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 2-deoxy-beta-L-galacto-heptopyranose |
Synonyms | (2S,4R,5S,6R)-6-((S)-1,2-dihydroxyethyl)tetrahydro-2H-pyran-2,4,5-triol; 2-deoxy-L-glycero-D-manno-heptose; 2-deoxy-beta-L-galacto-heptose; 2-deoxy-L-galacto-heptose; 2-deoxy-galacto-heptose |
Systematic Name (OpenEye OEToolkits) | (2S,4R,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]oxane-2,4,5-triol |
Formula | C7 H14 O6 |
Molecular Weight | 194.182 |
Type | D-SACCHARIDE, ALPHA LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OC1C(OC(O)CC1O)C(O)CO |
SMILES | CACTVS | 3.341 | OC[CH](O)[CH]1O[CH](O)C[CH](O)[CH]1O |
SMILES | OpenEye OEToolkits | 1.5.0 | C1C(C(C(OC1O)C(CO)O)O)O |
Canonical SMILES | CACTVS | 3.341 | OC[C@H](O)[C@H]1O[C@H](O)C[C@@H](O)[C@@H]1O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C1[C@H]([C@@H]([C@H](O[C@@H]1O)[C@H](CO)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C7H14O6/c8-2-4(10)7-6(12)3(9)1-5(11)13-7/h3-12H,1-2H2/t3-,4+,5+,6+,7-/m1/s1 |
InChIKey | InChI | 1.03 | XKBYYTRLKVABMB-PFCGLBSHSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 23644578 |