| PDB CCD ID: | A1A44 |
| Number of entries in BioLiP: | 4 |
| Chemical formula: | C29 H56 N O5 P |
| InChI: | InChI=1S/C29H56NO5P/c1-3-5-7-9-11-13-14-15-17-18-20-22-24-28-27(26-34-36(32,33)35-28)30-29(31)25-23-21-19-16-12-10-8-6-4-2/h22,24,27-28H,3-21,23,25-26H2,1-2H3,(H,30,31)(H,32,33)/b24-22+/t27-,28+/m0/s1 |
| InChIKey: | WCWADZSYRHRKHD-LVDQGNEYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | CCCCCCCCCCCC/C=C/[C@@H]1[C@H](COP(=O)(O1)O)NC(=O)CCCCCCCCCCC | | CACTVS 3.385 | CCCCCCCCCCCC/C=C/[C@H]1O[P](O)(=O)OC[C@@H]1NC(=O)CCCCCCCCCCC | | OpenEye OEToolkits 2.0.7 | CCCCCCCCCCCCC=CC1C(COP(=O)(O1)O)NC(=O)CCCCCCCCCCC | | CACTVS 3.385 | CCCCCCCCCCCCC=C[CH]1O[P](O)(=O)OC[CH]1NC(=O)CCCCCCCCCCC | | ACDLabs 14.52 | O=P1(O)OCC(NC(=O)CCCCCCCCCCC)C(/C=C/CCCCCCCCCCCC)O1 |
|
| Name: | N-{(2S,4R,5S)-2-hydroxy-2-oxo-4-[(1E,7Z)-tetradeca-1,7-dien-1-yl]-1,3,2lambda~5~-dioxaphosphinan-5-yl}dodecanamide |
