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Concept information

... > organooxygen compound > ester > phosphoric ester > phospholipid > glycerophospholipid > phosphatidic acid > 1,2-diacyl-sn-glycerol 3-phosphate > 1-palmitoyl-2-[(4z,7z,10z,13z,16z,19z)-docosahexaenoyl]-sn-glycero-3-phosphate
... > organooxygen compound > ester > phosphoric ester > carbohydrate phosphate > alditol phosphate > glycerol phosphate > sn-glycerol 3-phosphates > 1,2-diacyl-sn-glycerol 3-phosphate > 1-palmitoyl-2-[(4z,7z,10z,13z,16z,19z)-docosahexaenoyl]-sn-glycero-3-phosphate

Preferred term

1-palmitoyl-2-[(4z,7z,10z,13z,16z,19z)-docosahexaenoyl]-sn-glycero-3-phosphate  

Type

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

charge

  • 0

formula

  • C41H69O8P

inchi

  • InChI=1S/C41H69O8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-41(43)49-39(38-48-50(44,45)46)37-47-40(42)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,24,26,30,32,39H,3-4,6,8-10,12,14-16,19,22-23,25,27-29,31,33-38H2,1-2H3,(H2,44,45,46)/b7-5-,13-11-,18-17-,21-20-,26-24-,32-30-/t39-/m1/s1

inchikey

  • NXXSEGVRTTVEEI-QPKMWZFCSA-N

mass

  • 720.95550

monoisotopicmass

  • 720.47301

smiles

  • CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(O)(O)=O)OC(=O)CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC

subset

  • 3_STAR

synonym EXACT

  • (2R)-1-(hexadecanoyloxy)-3-(phosphonooxy)propan-2-yl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:83785

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