| PDB CCD ID: | UJO |
| Number of entries in BioLiP: | 6 |
| Chemical formula: | C29 H57 N O3 |
| InChI: | InChI=1S/C29H57NO3/c1-3-5-7-9-11-13-14-15-17-18-20-22-24-28(32)27(26-31)30-29(33)25-23-21-19-16-12-10-8-6-4-2/h22,24,27-28,31-32H,3-21,23,25-26H2,1-2H3,(H,30,33)/b24-22-/t27-,28+/m0/s1 |
| InChIKey: | CUYUYRQLXJHPEB-UWJMOZLHSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | CCCCCCCCCCCC/C=C\[C@H]([C@H](CO)NC(=O)CCCCCCCCCCC)O | | CACTVS 3.385 | CCCCCCCCCCCCC=C[CH](O)[CH](CO)NC(=O)CCCCCCCCCCC | | OpenEye OEToolkits 2.0.7 | CCCCCCCCCCCCC=CC(C(CO)NC(=O)CCCCCCCCCCC)O | | CACTVS 3.385 | CCCCCCCCCCCC\C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCCCCCCCC |
|
| Name: | ~{N}-[(~{Z},2~{S},3~{R})-1,3-bis(oxidanyl)heptadec-4-en-2-yl]dodecanamide |
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