MAY
Summary
Name: | METHYL ARACHIDONYL FLUOROPHOSPHONATE |
Synonyms: | MAFP |
Formula: | C21 H36 F O2 P |
Formal charge: | 0 |
Formula weight: | 370.482 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | methyl (S)-(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ylphosphonofluoridate |
OpenEye OEToolkits | 1.7.0 | (5Z,8Z,11Z,14Z)-1-[fluoro(methoxy)phosphoryl]icosa-5,8,11,14-tetraene |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | FP(=O)(OC)CCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC |
SMILES_CANONICAL | CACTVS | 3.370 | CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC[P@](F)(=O)OC |
SMILES | CACTVS | 3.370 | CCCCCC=CCC=CCC=CCC=CCCCC[P](F)(=O)OC |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC[P@](=O)(OC)F |
SMILES | OpenEye OEToolkits | 1.7.0 | CCCCCC=CCC=CCC=CCC=CCCCCP(=O)(OC)F |
InChI | InChI | 1.03 | InChI=1S/C21H36FO2P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(22,23)24-2/h7-8,10-11,13-14,16-17H,3-6,9,12,15,18-21H2,1-2H3/b8-7-,11-10-,14-13-,17-16-/t25-/m0/s1 |
InChIKey | InChI | 1.03 | KWKZCGMJGHHOKJ-WTIHWRCNSA-N |