CHEBI:189860 - 1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion

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ChEBI Name 1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion
ChEBI ID CHEBI:189860
ChEBI ASCII Name 1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion
Stars This entity has been manually annotated by a third party.
Submitter Lucila Aimo
Supplier Information
Download Molfile XML SDF
Formula C43H74NO8P
Net Charge 0
Average Mass 764.038
Monoisotopic Mass 763.51521
InChI InChI=1S/C43H74NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44(3)4)52-43(46)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h7-10,13-16,19-22,41H,5-6,11-12,17-18,23-40H2,1-4H3,(H,47,48)/b9-7-,10-8-,15-13-,16-14-,21-19-,22-20-/t41-/m1/s1
InChIKey NHTLNXKTYAMULV-WBFRYJMQSA-N
SMILES [C@@H](COC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)(COP(OCC[NH+](C)C)(=O)[O-])OC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O
ChEBI Ontology
Outgoing 1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion (CHEBI:189860) has functional parent α-linolenate (CHEBI:32387)
1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion (CHEBI:189860) is a 1,2-diacyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion (CHEBI:64572)
Synonyms Sources
1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine UniProt
PDME(18:3(9Z,12Z,15Z)/18: 3(9Z,12Z,15Z)) zwitterion SUBMITTER
Citation Waiting for Citations Type Source
3182818 PubMed citation SUBMITTER