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Concept information

Preferred term

pc(p-18:1(11z)/20:5(5z,8z,11z,14z,16e)-oh(18))  

Type

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

charge

  • 0

formula

  • C46H80NO8P

inchi

  • InChI=1S/C46H80NO8P/c1-6-8-10-11-12-13-14-15-16-17-20-23-26-29-32-35-40-52-42-45(43-54-56(50,51)53-41-39-47(3,4)5)55-46(49)38-34-31-28-25-22-19-18-21-24-27-30-33-37-44(48)36-9-7-2/h9,13-14,18-19,24-25,27-28,30,33,35-36,40,44-45,48H,6-8,10-12,15-17,20-23,26,29,31-32,34,37-39,41-43H2,1-5H3/b14-13-,19-18-,27-24-,28-25-,33-30+,36-9-,40-35+/t44?,45-/m1/s1

inchikey

  • VWTNLLOYCWJMJP-RDXYLUPMSA-N

mass

  • 806.119

monoisotopicmass

  • 805.56216

smiles

  • P(OCC[N+](C)(C)C)(OC[C@H](OC(=O)CCC/C=C/C/C=C/C/C=C/C=C/CC(O)/C=C/CC)CO/C=C/CCCCCCCC/C=C/CCCCCC)([O-])=O

subset

  • 2_STAR

synonym EXACT

  • [(2R)-2-[(5Z,8Z,11Z,13E,17Z)-16-hydroxyicosa-5,8,11,13,17-pentaenoyl]oxy-3-[(1E,11Z)-octadeca-1,11-dienoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230241

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