FEH
(1R)-1-phenylethane-1,2-diol
Created: | 2013-11-27 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 20 |
Chiral Atom Count | 1 |
Bond Count | 20 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | (1R)-1-phenylethane-1,2-diol |
Systematic Name (OpenEye OEToolkits) | (1R)-1-phenylethane-1,2-diol |
Formula | C8 H10 O2 |
Molecular Weight | 138.164 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC(c1ccccc1)CO |
SMILES | CACTVS | 3.385 | OC[CH](O)c1ccccc1 |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)C(CO)O |
Canonical SMILES | CACTVS | 3.385 | OC[C@H](O)c1ccccc1 |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)[C@H](CO)O |
InChI | InChI | 1.03 | InChI=1S/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H2/t8-/m0/s1 |
InChIKey | InChI | 1.03 | PWMWNFMRSKOCEY-QMMMGPOBSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 2724621 |