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Concept information

... > organooxygen compound > carboxamide > secondary carboxamide > sphingomyelin > sphingomyelin 37:0 > n-nonadecanoylsphinganine-1-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phosphocholines > sphingomyelin > sphingomyelin 37:0 > n-nonadecanoylsphinganine-1-phosphocholine
... > organooxygen compound > ester > choline ester > phosphocholines > sphingomyelin > sphingomyelin 37:0 > n-nonadecanoylsphinganine-1-phosphocholine
... > organooxygen compound > sphingolipid > phosphosphingolipid > sphingomyelin > sphingomyelin 37:0 > n-nonadecanoylsphinganine-1-phosphocholine

Preferred term

n-nonadecanoylsphinganine-1-phosphocholine  

Type

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

charge

  • 0

formula

  • C42H87N2O6P

has_functional_parent

inchi

  • InChI=1S/C42H87N2O6P/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/h40-41,45H,6-39H2,1-5H3,(H-,43,46,47,48)/t40-,41+/m0/s1

inchikey

  • GWOVFIGYPKRCCZ-WVILEFPPSA-N

mass

  • 747.125

monoisotopicmass

  • 746.63018

smiles

  • C(CCCCCCCCCC)CCCC[C@@H](O)[C@@H](NC(CCCCCCCCCCCCCCCCCC)=O)COP(=O)([O-])OCC[N+](C)(C)C

subset

  • 3_STAR

synonym EXACT

  • (2S,3R)-3-hydroxy-2-(nonadecanoylamino)octadecyl 2-(trimethylazaniumyl)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:90492

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