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Substance Name: 1,2-Di-(heptacosadiynoyl)-sn-glycero-3-phosphocholine
RN: 118024-74-1
InChIKey: AFGIQTGBUXLTHP-AKAJXFOGSA-N

Molecular Formula

  • C62-H108-N-O8-P

Molecular Weight

  • 1026.5082
 
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Names and Synonyms

Name of Substance

  • 1,2-Di-(heptacosadiynoyl)-sn-glycero-3-phosphocholine

Synonym

  • DC8,9PC

Systematic Name

  • 3,5,9-Trioxa-4-phosphahexatriaconta-20,22-diyn-1-aminium, 4-hydroxy-N,N,N-trimethyl-10-oxo-7-((1-oxo-11,13-heptacosadiynyl)oxy)-, hydroxide, inner salt, 4-oxide, (R)-

Registry Numbers

CAS Registry Number

  • 118024-74-1

System Generated Number

  • 0118024741

Structure Descriptors

InChI

1S/C62H108NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46-48-50-52-54-61(64)68-58-60(59-70-72(66,67)69-57-56-63(3,4)5)71-62(65)55-53-51-49-47-45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h60H,6-29,38-59H2,1-5H3/t60-/m1/s1

InChIKey

AFGIQTGBUXLTHP-AKAJXFOGSA-N

Smiles

CCCCCCCCCCCCCC#CC#CCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCC#CC#CCCCCCCCCCCCCC