α-fluoromethylenephosphonate (Q27074400)

alpha-fluoromethylenephosphonate (English)

3 October 2016

chemical formula

C₂₃H₄₄FO₆P

1 reference

alpha-fluoromethylenephosphonate (English)

3 October 2016

canonical SMILES

CCCCCCCCC=CCCCCCCCC(=O)OCC(CC(F)P(=O)(O)O)OC

1 reference

alpha-fluoromethylenephosphonate (English)

3 October 2016

isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@H](CC(F)P(=O)(O)O)OC

1 reference

alpha-fluoromethylenephosphonate (English)

InChI=1S/C23H44FO6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(25)30-20-21(29-2)19-22(24)31(26,27)28/h10-11,21-22H,3-9,12-20H2,1-2H3,(H2,26,27,28)/b11-10+/t21-,22?/m0/s1

3 October 2016

Identifiers

InChI

1 reference

alpha-fluoromethylenephosphonate (English)

KGVHPTQYUKZZPY-VXECIVMWSA-N

3 October 2016

InChIKey

1 reference

alpha-fluoromethylenephosphonate (English)

3 October 2016

1 reference

{(3S)-1-Fluoro-3-methoxy-4-[(9E)-9-octadecenoyloxy]butyl}phosphonic acid (English)

3 October 2016

2 references

alpha-fluoromethylenephosphonate (English)

matched by identifier from

3 October 2016

InChIKey

KGVHPTQYUKZZPY-VXECIVMWSA-N

1 reference

Guide to Pharmacology Ligand ID

CHEMBL190717 (English)

3 October 2016

1 reference

2915

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

2915

α-fluoromethylenephosphonate (English)