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Concept information

... > organooxygen compound > ester > phosphoric ester > phospholipid > phosphosphingolipid > sm(d18:1/22:6(5z,8e,10z,13z,15e,19z)-2oh(7s, 17s))
organooxygen compound > sphingolipid > phosphosphingolipid > sm(d18:1/22:6(5z,8e,10z,13z,15e,19z)-2oh(7s, 17s))

Preferred term

sm(d18:1/22:6(5z,8e,10z,13z,15e,19z)-2oh(7s, 17s))  

Type

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

Broader concept

charge

  • 0

formula

  • C45H79N2O8P

inchi

  • InChI=1S/C45H79N2O8P/c1-6-8-10-11-12-13-14-15-16-17-21-24-30-36-44(50)43(40-55-56(52,53)54-39-38-47(3,4)5)46-45(51)37-31-25-29-35-42(49)34-28-23-20-18-19-22-27-33-41(48)32-26-9-7-2/h9,19-20,22-23,26-30,33-36,41-44,48-50H,6-8,10-18,21,24-25,31-32,37-40H2,1-5H3,(H-,46,51,52,53)/b22-19-,23-20-,26-9-,33-27+,34-28+,35-29-,36-30+/t41-,42-,43-,44+/m0/s1

inchikey

  • KKWKIYPNSWEREE-HRSCZNOHSA-N

mass

  • 807.107

monoisotopicmass

  • 806.55740

smiles

  • P(OCC[N+](C)(C)C)(OC[C@H](NC(=O)CCC/C=C/[C@@H](O)/C=C/C=C/C/C=C/C=C/[C@@H](O)C/C=C/CC)[C@H](O)/C=C/CCCCCCCCCCCCC)([O-])=O

subset

  • 2_STAR

synonym EXACT

  • [(E,2S,3R)-2-[[(5Z,7R,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenoyl]amino]-3-hydroxyoctadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:231012

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