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Concept information

... > organooxygen compound > carboxamide > secondary carboxamide > sphingomyelin > sphingomyelin 38:1 > n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phosphocholines > sphingomyelin > sphingomyelin 38:1 > n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine
... > chemical entity > molecular entity > ion > cation > organic cation > quaternary ammonium ion > cholines > phosphocholines > sphingomyelin > sphingomyelin 38:1 > n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine
... > chemical entity > molecular entity > ion > organic ion > organic cation > quaternary ammonium ion > cholines > phosphocholines > sphingomyelin > sphingomyelin 38:1 > n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > ester > choline ester > phosphocholines > sphingomyelin > sphingomyelin 38:1 > n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phospholipid > phosphosphingolipid > sphingomyelin > sphingomyelin 38:1 > n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > sphingolipid > phosphosphingolipid > sphingomyelin > sphingomyelin 38:1 > n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine

Preferred term

n-henicosanoyl-14-methylhexadecasphingosine-1-phosphocholine  

Type

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

Broader concept

charge

  • 0

formula

  • C43H87N2O6P

inchi

  • InChI=1S/C43H87N2O6P/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-30-33-36-43(47)44-41(39-51-52(48,49)50-38-37-45(4,5)6)42(46)35-32-29-26-24-23-25-28-31-34-40(3)8-2/h32,35,40-42,46H,7-31,33-34,36-39H2,1-6H3,(H-,44,47,48,49)/b35-32+/t40?,41-,42+/m0/s1

inchikey

  • UUTLYHFNYZWXDD-UODHHMPYSA-N

mass

  • 759.136

monoisotopicmass

  • 758.63018

smiles

  • C(CCCCCC(CC)C)CC/C=C/[C@@H](O)[C@@H](NC(CCCCCCCCCCCCCCCCCCCC)=O)COP(OCC[N+](C)(C)C)(=O)[O-]

subset

  • 3_STAR

synonym EXACT

  • (2S,3R,4E)-2-(henicosanoylamino)-3-hydroxy-14-methylhexadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:119470

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