CHEBI:77749 - 1-palmitoyl-2-(10-hydroperoxy-8E-octadecenoyl)-sn-glycero-3-phosphocholine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 1-palmitoyl-2-(10-hydroperoxy-8E-octadecenoyl)-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:77749
ChEBI ASCII Name 1-palmitoyl-2-(10-hydroperoxy-8E-octadecenoyl)-sn-glycero-3-phosphocholine
Definition is_a_ CHEBI:64517 in which 1 and 2-acyl groups are specified as hexadecanoyl and 10-hydroperoxy 8E-octadecenoyl respectively.
Stars This entity has been manually annotated by a third party.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C42H82NO10P
Net Charge 0
Average Mass 792.07498
Monoisotopic Mass 791.56763
InChI InChI=1S/C42H82NO10P/c1-6-8-10-12-14-15-16-17-18-19-20-25-29-33-41(44)49-37-40(38-51-54(47,48)50-36-35-43(3,4)5)52-42(45)34-30-26-22-21-24-28-32-39(53-46)31-27-23-13-11-9-7-2/h28,32,39-40H,6-27,29-31,33-38H2,1-5H3,(H-,46,47,48)/b32-28+/t39?,40-/m1/s1
InChIKey WDVMUQGXOAZRKX-JLMWPCEGSA-N
SMILES [H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCC\C=C\C(CCCCCCCC)OO
ChEBI Ontology
Outgoing 1-palmitoyl-2-(10-hydroperoxy-8E-octadecenoyl)-sn-glycero-3-phosphocholine (CHEBI:77749) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
1-hexadecanoyl-2-(10-hydroperoxy-8E-octadecenoyl)-sn-glycero-3-phosphocholine UniProt
1-O-hexadecyl-2-(10-hydroperoxy-8E-octadecenoyl)-sn-glycero-3-phosphocholine SUBMITTER
Citation Waiting for Citations Type Source
17090529 PubMed citation SUBMITTER
Last Modified
01 December 2014