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Concept information

... > organooxygen compound > carboxamide > secondary carboxamide > sphingomyelin > sphingomyelin 33:1 > n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phosphocholines > sphingomyelin > sphingomyelin 33:1 > n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine
... > chemical entity > molecular entity > ion > cation > organic cation > quaternary ammonium ion > cholines > phosphocholines > sphingomyelin > sphingomyelin 33:1 > n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine
... > chemical entity > molecular entity > ion > organic ion > organic cation > quaternary ammonium ion > cholines > phosphocholines > sphingomyelin > sphingomyelin 33:1 > n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > ester > choline ester > phosphocholines > sphingomyelin > sphingomyelin 33:1 > n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phospholipid > phosphosphingolipid > sphingomyelin > sphingomyelin 33:1 > n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine
... > organooxygen compound > sphingolipid > phosphosphingolipid > sphingomyelin > sphingomyelin 33:1 > n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine

Preferred term

n-hexadecanoyl-15-methylhexadecasphingosine-1-phosphocholine  

Type

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

Broader concept

charge

  • 0

formula

  • C38H77N2O6P

inchi

  • InChI=1S/C38H77N2O6P/c1-7-8-9-10-11-12-13-14-15-19-22-25-28-31-38(42)39-36(34-46-47(43,44)45-33-32-40(4,5)6)37(41)30-27-24-21-18-16-17-20-23-26-29-35(2)3/h27,30,35-37,41H,7-26,28-29,31-34H2,1-6H3,(H-,39,42,43,44)/b30-27+/t36-,37+/m0/s1

inchikey

  • RPGLLSNDDVGBOW-YTIXFSKQSA-N

mass

  • 689.003

monoisotopicmass

  • 688.55193

smiles

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

subset

  • 3_STAR

synonym EXACT

  • (2S,3R,4E)-2-(hexadecanoylamino)-3-hydroxy-15-methylhexadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116963

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