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Substance Name: 1,2-Docosahexanoyl-sn-glycero-3-phosphoethanolamine
RN: 123284-81-1
UNII: 146IH66H58
InChIKey: RBDNSJMXMWTPCS-NYUVKXDYSA-N

Molecular Formula

  • C49-H74-N-O8-P

Molecular Weight

  • 836.0966
 
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Names and Synonyms

Name of Substance

  • 1,2-Docosahexanoyl-sn-glycero-3-phosphoethanolamine

Synonyms

  • 1,2-Docosahexanoyl-sn-glycero-3-phosphoethanolamine
  • 4,7,10,13,16,19-Docosahexaenoic acid, 1,1'-((1R)-1-((((2-aminoethoxy)hydroxyphosphinyl)oxy)methyl)-1,2-ethanediyl) ester, (4Z,4'Z,7Z,7'Z,10Z,10'Z,13Z,13'Z,16Z,16'Z,19Z,19'Z)-
  • UNII-146IH66H58

Registry Numbers

CAS Registry Number

  • 123284-81-1

FDA UNII

  • 146IH66H58

System Generated Number

  • 0123284811

Structure Descriptors

InChI

1S/C49H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-48(51)55-45-47(46-57-59(53,54)56-44-43-50)58-49(52)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-32,35-38,47H,3-4,9-10,15-16,21-22,27-28,33-34,39-46,50H2,1-2H3,(H,53,54)/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-/t47-/m1/s1

InChIKey

RBDNSJMXMWTPCS-NYUVKXDYSA-N

Smiles

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC