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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > phosphoric ester > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > phosphoric ester > phosphocholines > sm(d14:0/27:0)
organooxygen compound > ester > phosphoric ester > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > organic phosphate > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > organic phosphate > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > phosphate > organic phosphate > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > phosphate > organic phosphate > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > ammonium ion derivative > quaternary ammonium ion > cholines > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > quaternary ammonium ion > cholines > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > quaternary ammonium ion > cholines > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > quaternary ammonium ion > cholines > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > ion > cation > organic cation > quaternary ammonium ion > cholines > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > ion > organic ion > organic cation > quaternary ammonium ion > cholines > phosphocholines > sm(d14:0/27:0)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic cation > quaternary ammonium ion > cholines > phosphocholines > sm(d14:0/27:0)
organooxygen compound > ester > choline ester > phosphocholines > sm(d14:0/27:0)

Preferred term

sm(d14:0/27:0)  

Type

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

Broader concept

charge

  • 0

formula

  • C46H95N2O6P

inchi

  • InChI=1S/C46H95N2O6P/c1-6-8-10-12-14-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-46(50)47-44(43-54-55(51,52)53-42-41-48(3,4)5)45(49)39-37-35-33-31-15-13-11-9-7-2/h44-45,49H,6-43H2,1-5H3,(H-,47,50,51,52)/t44-,45+/m0/s1

inchikey

  • SHGMMFOWDHTTNK-YWPUXERESA-N

mass

  • 803.248

monoisotopicmass

  • 802.69278

smiles

  • P(OC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCC)[C@H](O)CCCCCCCCCCC)(OCC[N+](C)(C)C)([O-])=O

subset

  • 2_STAR

synonym EXACT

  • [(2S,3R)-2-(heptacosanoylamino)-3-hydroxytetradecyl] 2-(trimethylazaniumyl)ethyl phosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176742

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