skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carboxamide > secondary carboxamide > sphingomyelin > sphingomyelin d18:1 > n-nonadecanoylsphingosine-1-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phosphocholines > sphingomyelin > sphingomyelin d18:1 > n-nonadecanoylsphingosine-1-phosphocholine
... > organooxygen compound > ester > choline ester > phosphocholines > sphingomyelin > sphingomyelin d18:1 > n-nonadecanoylsphingosine-1-phosphocholine
... > organooxygen compound > sphingolipid > phosphosphingolipid > sphingomyelin > sphingomyelin d18:1 > n-nonadecanoylsphingosine-1-phosphocholine

Preferred term

n-nonadecanoylsphingosine-1-phosphocholine  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C42H85N2O6P

has_functional_parent

inchi

  • InChI=1S/C42H85N2O6P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-36-42(46)43-40(39-50-51(47,48)49-38-37-44(3,4)5)41(45)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2/h33,35,40-41,45H,6-32,34,36-39H2,1-5H3,(H-,43,46,47,48)/b35-33+/t40-,41+/m0/s1

inchikey

  • HAFQHLHNPJDAGB-MAJDXUCPSA-N

mass

  • 745.10790

monoisotopicmass

  • 744.61453

smiles

  • CCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)[C@H](O)/C=C/CCCCCCCCCCCCC

subset

  • 3_STAR

synonym EXACT

  • (2S,3R,4E)-3-hydroxy-2-(nonadecanoylamino)octadec-4-en-1-yl 2-(trimethylammonio)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:84485

Download this concept: