Chemical Component Summary

Name(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihydrogen phosphate
Synonymssphingosine 1-phosphate
Identifiers[(E,2S,3R)-2-azanyl-3-hydroxy-octadec-4-enyl] dihydrogen phosphate
FormulaC18 H38 N O5 P
Molecular Weight379.472
TypeNON-POLYMER
Isomeric SMILESCCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)(O)O)N)O
InChIInChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
InChIKeyDUYSYHSSBDVJSM-KRWOKUGFSA-N

Chemical Details

Formal Charge0
Atom Count63
Chiral Atom Count2
Bond Count62
Aromatic Bond Count0

Related Resource References

Resource NameReference
Pharos CHEMBL225155
PubChem 5283560, 10883396
ChEMBL CHEMBL225155
ChEBI CHEBI:37550