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Substance Name: 2,3-O-Bis(10,12-tricosadiynyl)glycero-1-phosphocholine
RN: 143062-81-1
InChIKey: AFXWCJBJZJSOEP-XSMLMOGHSA-N

Molecular Formula

  • C54-H96-N-O6-P

Molecular Weight

  • 886.327
 
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Names and Synonyms

Name of Substance

  • 2,3-O-Bis(10,12-tricosadiynyl)glycero-1-phosphocholine

Synonym

  • 2,3-Btgpc

Systematic Name

  • 3,5,9-Trioxa-4-phosphadotriaconta-19,21-diyn-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-(10,12-tricosadiynyloxy)-, hydroxide, inner salt, 4-oxide, (S)-

Registry Numbers

CAS Registry Number

  • 143062-81-1

System Generated Number

  • 0143062811

Structure Descriptors

InChI

1S/C54H96NO6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46-49-58-52-54(53-61-62(56,57)60-51-48-55(3,4)5)59-50-47-45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h54H,6-23,32-53H2,1-5H3/t54-/m0/s1

InChIKey

AFXWCJBJZJSOEP-XSMLMOGHSA-N

Smiles

C(COP(OC[C@H](COCCCCCCCCCC#CC#CCCCCCCCCCC)OCCCCCCCCCC#CC#CCCCCCCCCCC)(=O)[O-])[N+](C)(C)C