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Concept information

... > organooxygen compound > ester > phosphoric ester > phosphocholines > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium
... > chemical entity > molecular entity > ion > cation > organic cation > quaternary ammonium ion > cholines > phosphocholines > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium
... > organooxygen compound > ester > choline ester > phosphocholines > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium
... > organooxygen compound > ester > phosphoric ester > phospholipid > glycerophospholipid > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium
... > organooxygen compound > ester > phosphoric ester > phosphocholines > glycerophosphocholine > phosphatidylcholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium
... > organooxygen compound > ester > choline ester > phosphocholines > glycerophosphocholine > phosphatidylcholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium

Preferred term

2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium  

Type

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

charge

  • +1

formula

  • C20H41NO8P

inchi

  • InChI=1S/C20H40NO8P/c1-6-8-10-12-19(22)26-16-18(29-20(23)13-11-9-7-2)17-28-30(24,25)27-15-14-21(3,4)5/h18H,6-17H2,1-5H3/p+1/t18-/m0/s1

inchikey

  • DVZARZBAWHITHR-SFHVURJKSA-O

mass

  • 454.520

monoisotopicmass

  • 454.25643

smiles

  • P(OCC[N+](C)(C)C)(OC[C@@H](OC(=O)CCCCC)COC(=O)CCCCC)(O)=O

subset

  • 2_STAR

synonym EXACT

  • 2-[[(2S)-2,3-di(hexanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:194707

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