PDB CCD ID: | 79M |
Number of entries in BioLiP: | 44 |
Chemical formula: | C19 H36 O4 |
InChI: | InChI=1S/C19H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h9-10,18,20-21H,2-8,11-17H2,1H3/b10-9-/t18-/m1/s1 |
InChIKey: | OWGMAJRKMYGYBQ-HJCTWCACSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.9.2 | CCCCCCCC/C=C\CCCCCC(=O)OC[C@@H](CO)O | ACDLabs 12.01 | O=C(OCC(O)CO)CCCCC\C=C/CCCCCCCC | CACTVS 3.385 | CCCCCCCCC=CCCCCCC(=O)OC[CH](O)CO | CACTVS 3.385 | CCCCCCCC\C=C/CCCCCC(=O)OC[C@H](O)CO | OpenEye OEToolkits 1.9.2 | CCCCCCCCC=CCCCCCC(=O)OCC(CO)O |
|
Name: | (2R)-2,3-dihydroxypropyl (7Z)-hexadec-7-enoate; [(2R)-2,3-bis(oxidanyl)propyl] (Z)-hexadec-7-enoate |
ZINC: | ZINC000098208566 |