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Concept information

... > organooxygen compound > ester > phosphoric ester > phosphocholines > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > phosphatidylcholine 38:4 > 1-[(9z)-octadecenoyl]-2-[(5z,8z,11z)-eicosatrienoyl]-sn-glycero-3-phosphocholine
... > organooxygen compound > ester > choline ester > phosphocholines > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > phosphatidylcholine 38:4 > 1-[(9z)-octadecenoyl]-2-[(5z,8z,11z)-eicosatrienoyl]-sn-glycero-3-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phospholipid > glycerophospholipid > glycerophosphocholine > 1,2-diacyl-sn-glycero-3-phosphocholine > phosphatidylcholine 38:4 > 1-[(9z)-octadecenoyl]-2-[(5z,8z,11z)-eicosatrienoyl]-sn-glycero-3-phosphocholine
... > organooxygen compound > ester > phosphoric ester > phosphocholines > glycerophosphocholine > phosphatidylcholine > 1,2-diacyl-sn-glycero-3-phosphocholine > phosphatidylcholine 38:4 > 1-[(9z)-octadecenoyl]-2-[(5z,8z,11z)-eicosatrienoyl]-sn-glycero-3-phosphocholine
... > organooxygen compound > ester > choline ester > phosphocholines > glycerophosphocholine > phosphatidylcholine > 1,2-diacyl-sn-glycero-3-phosphocholine > phosphatidylcholine 38:4 > 1-[(9z)-octadecenoyl]-2-[(5z,8z,11z)-eicosatrienoyl]-sn-glycero-3-phosphocholine

Preferred term

1-[(9z)-octadecenoyl]-2-[(5z,8z,11z)-eicosatrienoyl]-sn-glycero-3-phosphocholine  

Type

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

Broader concept

charge

  • 0

formula

  • C46H84NO8P

inchi

  • InChI=1S/C46H84NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h20-22,24-25,27,31,33,44H,6-19,23,26,28-30,32,34-43H2,1-5H3/b22-20-,24-21-,27-25-,33-31-/t44-/m1/s1

inchikey

  • APIPSPZJMLSCBO-NRTPYZNRSA-N

mass

  • 810.13480

monoisotopicmass

  • 809.59346

smiles

  • CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCC/C=C/C/C=C/C/C=C/CCCCCCCC

subset

  • 3_STAR

synonym EXACT

  • (2R)-2-{[(5Z,8Z,11Z)-icosa-5,8,11-trienoyl]oxy}-3-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:86178

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