L2C
(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE
| Created: | 2006-07-31 |
| Last modified: | 2011-06-04 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 75 |
| Chiral Atom Count | 1 |
| Bond Count | 74 |
| Aromatic Bond Count | 0 |
Chemical Component Summary | |
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| Name | (2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE |
| Systematic Name (OpenEye OEToolkits) | [(2S)-3-hydroxy-2-nonanoyloxy-propyl] dodecanoate |
| Formula | C24 H46 O5 |
| Molecular Weight | 414.619 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OC(COC(=O)CCCCCCCCCCC)CO)CCCCCCCC |
| SMILES | CACTVS | 3.341 | CCCCCCCCCCCC(=O)OC[CH](CO)OC(=O)CCCCCCCC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC |
| Canonical SMILES | CACTVS | 3.341 | CCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCC |
| Canonical SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C24H46O5/c1-3-5-7-9-11-12-13-15-16-18-23(26)28-21-22(20-25)29-24(27)19-17-14-10-8-6-4-2/h22,25H,3-21H2,1-2H3/t22-/m0/s1 |
| InChIKey | InChI | 1.03 | MYFVXYUACRBWGD-QFIPXVFZSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 15991540 |














