YHO
(1S,2S,3R,4R)-4-aminocyclopentane-1,2,3-triol
Created: | 2008-07-25 |
Last modified: | 2011-06-04 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 20 |
Chiral Atom Count | 4 |
Bond Count | 20 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (1S,2S,3R,4R)-4-aminocyclopentane-1,2,3-triol |
Systematic Name (OpenEye OEToolkits) | (1S,2S,3R,4R)-4-aminocyclopentane-1,2,3-triol |
Formula | C5 H11 N O3 |
Molecular Weight | 133.146 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OC1CC(N)C(O)C1O |
SMILES | CACTVS | 3.341 | N[CH]1C[CH](O)[CH](O)[CH]1O |
SMILES | OpenEye OEToolkits | 1.5.0 | C1C(C(C(C1O)O)O)N |
Canonical SMILES | CACTVS | 3.341 | N[C@@H]1C[C@H](O)[C@H](O)[C@@H]1O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C1[C@H]([C@H]([C@H]([C@H]1O)O)O)N |
InChI | InChI | 1.03 | InChI=1S/C5H11NO3/c6-2-1-3(7)5(9)4(2)8/h2-5,7-9H,1,6H2/t2-,3+,4-,5+/m1/s1 |
InChIKey | InChI | 1.03 | UUKWSEIZIMUXPU-LECHCGJUSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 11593442 |
ChEMBL | CHEMBL268037 |