N-hexacosanoyl-14-methylhexadecasphinganine-1-phosphocholine
A sphingomyelin obtained by formal condensation of the carboxy group of hexacosanoic acid with the amino group of 14-methylhexadecasphinganine-1-phosphocholine. It is a metabolite of the nematode Caenorhabditis elegans.
Exact Synonyms
(2S,3R)-2-(hexacosanoylamino)-3-hydroxy-14-methylhexadecyl 2-(trimethylazaniumyl)ethyl phosphate
Related Synonyms
N-hexacosanoyl-14-methylhexadecadihydrosphingosine-1-phosphocholine
SM (d17:0;3/26:0)
SM 43:0;3
- chemical entity (200,444)
- molecular entity (196,129)
- ion (14,247)
- cation (4,379)
- organic cation (3,876)
- quaternary ammonium ion (2,456)
- polyatomic cation (3,415)
- ammonium ion derivative (3,261)
- quaternary ammonium ion (2,456)
- ammonium ion derivative (3,261)
- organic cation (3,876)
- organic ion (13,247)
- organic cation (3,876)
- quaternary ammonium ion (2,456)
- organic cation (3,876)
- polyatomic ion (8,964)
- polyatomic cation (3,415)
- ammonium ion derivative (3,261)
- quaternary ammonium ion (2,456)
- ammonium ion derivative (3,261)
- polyatomic cation (3,415)
- cation (4,379)
- main group molecular entity (194,229)
- p-block molecular entity (193,541)
- carbon group molecular entity (189,246)
- organic molecular entity (189,106)
- heteroorganic entity (151,906)
- organochalcogen compound (125,492)
- organooxygen compound (119,501)
- carboxamide (32,463)
- ester (27,947)
- choline ester (2,233)
- phosphoric ester (10,480)
- sphingolipid (2,553)
- organooxygen compound (119,501)
- organonitrogen compound (70,247)
- carboxamide (32,463)
- quaternary nitrogen compound (2,150)
- sphingolipid (2,553)
- organophosphorus compound (10,709)
- organochalcogen compound (125,492)
- lipid (38,235)
- organic ion (13,247)
- organic cation (3,876)
- quaternary ammonium ion (2,456)
- organic cation (3,876)
- organic molecule (108,434)
- dipolar compound (3,258)
- zwitterion (3,237)
- dipolar compound (3,258)
- heteroorganic entity (151,906)
- organic molecular entity (189,106)
- chalcogen molecular entity (138,750)
- organochalcogen compound (125,492)
- organooxygen compound (119,501)
- carboxamide (32,463)
- ester (27,947)
- choline ester (2,233)
- phosphoric ester (10,480)
- sphingolipid (2,553)
- organooxygen compound (119,501)
- oxygen molecular entity (132,386)
- organooxygen compound (119,501)
- carboxamide (32,463)
- ester (27,947)
- choline ester (2,233)
- phosphoric ester (10,480)
- sphingolipid (2,553)
- organooxygen compound (119,501)
- organochalcogen compound (125,492)
- pnictogen molecular entity (88,874)
- nitrogen molecular entity (79,787)
- amide (39,309)
- primary amide (37,379)
- ammonium ion derivative (3,261)
- quaternary ammonium ion (2,456)
- organonitrogen compound (70,247)
- carboxamide (32,463)
- quaternary nitrogen compound (2,150)
- sphingolipid (2,553)
- amide (39,309)
- phosphorus molecular entity (14,481)
- organophosphorus compound (10,709)
- phosphorus oxoacids and derivatives (14,318)
- phosphorus oxoacid derivative (14,163)
- phosphoric acid derivative (14,079)
- organic phosphate (10,616)
- phosphate (10,654)
- phosphoric ester (10,480)
- phosphoric acid derivative (14,079)
- phosphorus oxoacid derivative (14,163)
- nitrogen molecular entity (79,787)
- carbon group molecular entity (189,246)
- p-block molecular entity (193,541)
- polyatomic entity (140,025)
- heteroatomic molecular entity (60,413)
- oxoacid derivative (19,341)
- phosphorus oxoacid derivative (14,163)
- phosphoric acid derivative (14,079)
- organic phosphate (10,616)
- phosphate (10,654)
- phosphoric ester (10,480)
- phosphoric acid derivative (14,079)
- phosphorus oxoacid derivative (14,163)
- oxoacid derivative (19,341)
- molecule (108,973)
- organic molecule (108,434)
- dipolar compound (3,258)
- zwitterion (3,237)
- dipolar compound (3,258)
- organic molecule (108,434)
- polyatomic ion (8,964)
- polyatomic cation (3,415)
- ammonium ion derivative (3,261)
- quaternary ammonium ion (2,456)
- ammonium ion derivative (3,261)
- polyatomic cation (3,415)
- heteroatomic molecular entity (60,413)
- ion (14,247)
- molecular entity (196,129)
class Information
charge
0
formula
C48H99N2O6P
has_dbxref
has_obo_namespace
chebi_ontology
inchi
InChI=1S/C48H99N2O6P/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-32-35-38-41-48(52)49-46(44-56-57(53,54)55-43-42-50(4,5)6)47(51)40-37-34-31-29-28-30-33-36-39-45(3)8-2/h45-47,51H,7-44H2,1-6H3,(H-,49,52,53,54)/t45?,46-,47+/m0/s1
inchikey
URKGNSIZAASXFK-MKISUTETSA-N
in_subset
mass
831.285
monoisotopicmass
830.72408
smiles
C(CCCCCC(CC)C)CCCC[C@@H](O)[C@@H](NC(CCCCCCCCCCCCCCCCCCCCCCCCC)=O)COP(OCC[N+](C)(C)C)(=O)[O-]