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Substance Name: 1,2-Bis(1,2-(lipoyl)dodecanoyl)-sn-glycero-3-phosphocholine
RN: 104778-79-2
InChIKey: MGHUBYHQXKUOFS-UHFFFAOYSA-N

Molecular Formula

  • C48-H88-N-O12-P-S4

Molecular Weight

  • 1030.4562
 
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Names and Synonyms

Name of Substance

  • 1,2-Bis(1,2-(lipoyl)dodecanoyl)-sn-glycero-3-phosphocholine

Synonyms

  • 1,2-Bis(1,2-(lipoyl)dodecanoyl)phosphatidylcholine
  • Dilipoyl lipid

Systematic Name

  • 3,5,9,22-Tetraoxa-4-phosphaheptacosan-1-aminium, 27-(1,2-dithiolan-4-yl)-7-((12-((5-(1,2-dithiolan-4-yl)-1-oxopentyl)oxy)-1-oxodocecyl)oxy)-4-hydroxy-N,N,N-trimethyl-10,23-dioxo-, hydroxide, inner salt 4-oxide (+-)-

Registry Numbers

CAS Registry Number

  • 104778-79-2

System Generated Number

  • 0104778792

Structure Descriptors

InChI

1S/C48H88NO12PS4/c1-49(2,3)32-35-59-62(54,55)60-37-44(61-48(53)31-19-15-11-7-5-9-13-17-25-34-57-46(51)30-23-21-27-43-40-65-66-41-43)36-58-47(52)28-18-14-10-6-4-8-12-16-24-33-56-45(50)29-22-20-26-42-38-63-64-39-42/h42-44H,4-41H2,1-3H3

InChIKey

MGHUBYHQXKUOFS-UHFFFAOYSA-N

Smiles

C[N+](C)(C)CCOP(=O)([O-])OCC(COC(=O)CCCCCCCCCCCOC(=O)CCCCC1CSSC1)OC(=O)CCCCCCCCCCCOC(=O)CCCCC2CSSC2