2OP
(2S)-2-HYDROXYPROPANOIC ACID
Created: | 2004-12-29 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 12 |
Chiral Atom Count | 1 |
Bond Count | 11 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2S)-2-HYDROXYPROPANOIC ACID |
Systematic Name (OpenEye OEToolkits) | (2S)-2-hydroxypropanoic acid |
Formula | C3 H6 O3 |
Molecular Weight | 90.078 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(O)C |
SMILES | CACTVS | 3.370 | C[CH](O)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.0 | CC(C(=O)O)O |
Canonical SMILES | CACTVS | 3.370 | C[C@H](O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | C[C@@H](C(=O)O)O |
InChI | InChI | 1.03 | InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m0/s1 |
InChIKey | InChI | 1.03 | JVTAAEKCZFNVCJ-REOHCLBHSA-N |
Drug Info: DrugBank
DrugBank ID | DB14475 |
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Name | L-Lactic acid |
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Brand Names |
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Categories |
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CAS number | 79-33-4 |
Related Resource References
Resource Name | Reference |
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PubChem | 107689 |
ChEMBL | CHEMBL330546 |
ChEBI | CHEBI:422 |
CCDC/CSD | YILLAG, XAMCEW, LEJMOE, PALCAH, VAKQIK, YILLAG01, YILLAG02, YILLAG03 |