VLZ
1,3-dihydroxypropan-2-yl dodecanoate
Created: | 2020-09-15 |
Last modified: | 2021-03-10 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 49 |
Chiral Atom Count | 0 |
Bond Count | 48 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 1,3-dihydroxypropan-2-yl dodecanoate |
Synonyms | 2-lauroylglycerol |
Systematic Name (OpenEye OEToolkits) | 1,3-bis(oxidanyl)propan-2-yl dodecanoate |
Formula | C15 H30 O4 |
Molecular Weight | 274.396 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O(C(CO)CO)C(=O)CCCCCCCCCCC |
SMILES | CACTVS | 3.385 | CCCCCCCCCCCC(=O)OC(CO)CO |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCC(=O)OC(CO)CO |
Canonical SMILES | CACTVS | 3.385 | CCCCCCCCCCCC(=O)OC(CO)CO |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCC(=O)OC(CO)CO |
InChI | InChI | 1.03 | InChI=1S/C15H30O4/c1-2-3-4-5-6-7-8-9-10-11-15(18)19-14(12-16)13-17/h14,16-17H,2-13H2,1H3 |
InChIKey | InChI | 1.03 | ZUCMOZYYSZYRRM-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 74297 |
ChEBI | CHEBI:75453 |