(R)-3-(((4Z,7Z,10Z,13Z,16Z,19Z)-Docosa-4,7,10,13,16,19-hexaenoyl)oxy)-2-(oleoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate

Catalog No. :
ACGSDB299
CAS No. :
99265-02-8
Molecular Formula :
C48H82NO8P
Molecular Weight :
832.16

IUPAC Name:(R)-3-(((4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl)oxy)-2-(oleoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate

(R)-3-(((4Z,7Z,10Z,13Z,16Z,19Z)-Docosa-4,7,10,13,16,19-hexaenoyl)oxy)-2-(oleoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate structure diagram
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Product Information

Product Name(R)-3-(((4Z,7Z,10Z,13Z,16Z,19Z)-Docosa-4,7,10,13,16,19-hexaenoyl)oxy)-2-(oleoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate
IUPAC Name(R)-3-(((4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl)oxy)-2-(oleoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate
Molecular FormulaC48H82NO8P
Molecular Weight832.16
SMILESO=P(OC[C@H](OC(CCCCCCC/C=C\CCCCCCCC)=O)COC(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)([O-])OCC[N+](C)(C)C
InChI KeyNDBRCNIXDRLLSE-GSUBHOBPSA-N
Synonym1-Docosahexaenoin-2-oleoyl 3-Phosphocholine;[(2R)-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-2-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate;[R-(all-Z)]-4-Hydroxy-N,N,N-triMethyl-10-oxo-7-[(1-oxo-9-octadecenyl)oxy]-3,5,9-trioxa-4-phosphahentriaconta-13,16,19,22,25,28-hexaen-1-aMiniuM Inner Salt 4-Oxide
CAS No.99265-02-8

Synthetic Route by SureRoute

1. ACGSDB299 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACGSDB299 route product structure diagram
    ACGSDB29999265-02-8
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2. ACGSDB299 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACGSDB299 route product structure diagram
    ACGSDB29999265-02-8
Inquiry

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