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Concept information

... > organooxygen compound > ester > phosphoric ester > phospholipid > glycerophospholipid > glycerophosphoinositol > phosphatidylinositol > pi(22:6(4z,7z,10z,13z,16z,19z)/20:5(5z,8z,11z,14z,17z))

Preferred term

pi(22:6(4z,7z,10z,13z,16z,19z)/20:5(5z,8z,11z,14z,17z))  

Type

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

Broader concept

charge

  • 0

formula

  • C51H77O13P

inchi

  • InChI=1S/C51H77O13P/c1-3-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-39-44(52)61-41-43(42-62-65(59,60)64-51-49(57)47(55)46(54)48(56)50(51)58)63-45(53)40-38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,22,24,26-29,32-35,43,46-51,54-58H,3-4,9-10,15-16,21,23,25,30-31,36-42H2,1-2H3,(H,59,60)/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,24-22-,28-26-,29-27-,34-32-,35-33-/t43-,46?,47-,48?,49?,50?,51?/m1/s1

inchikey

  • VCBVTZQBRVUKBP-XZVJXJPZSA-N

mass

  • 929.138

monoisotopicmass

  • 928.51018

smiles

  • P(OC1C(O)C(O)C(O)[C@@H](O)C1O)(OC[C@H](OC(=O)CCC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC)COC(=O)CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [(2R)-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-2-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184715

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