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Concept information

... > organooxygen compound > ester > phosphoric ester > phosphocholines > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine
... > organooxygen compound > ester > choline ester > phosphocholines > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine
organooxygen compound > carbonyl compound > aldehyde > 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine

Preferred term

1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine  

Type

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

charge

  • 0

formula

  • C31H60NO9P

has_functional_parent

inchi

  • InChI=1S/C31H60NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-19-22-30(34)38-27-29(41-31(35)23-20-17-18-21-25-33)28-40-42(36,37)39-26-24-32(2,3)4/h25,29H,5-24,26-28H2,1-4H3/t29-/m1/s1

inchikey

  • ZFFOCRIWYYAJIJ-GDLZYMKVSA-N

mass

  • 621.784

monoisotopicmass

  • 621.40057

smiles

  • O([C@H](COC(=O)CCCCCCCCCCCCCCC)COP(OCC[N+](C)(C)C)(=O)[O-])C(=O)CCCCCC([H])=O

subset

  • 3_STAR

synonym EXACT

  • 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine
  • (2R)-3-(hexadecanoyloxy)-2-[(7-oxoheptanoyl)oxy]propyl 2-(trimethylazaniumyl)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:134601

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