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Substance Name: 1-Pyrenebutyrylcarnitine
RN: 81923-90-2
InChIKey: XLZUNRCLJXKEIE-UHFFFAOYSA-N

Molecular Weight

  • 431.529
 
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Names and Synonyms

Name of Substance

  • 1-Pyrenebutyrylcarnitine

Synonym

  • (1-Pyrenebutyryl)carnitine

Systematic Name

  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-(1-oxo-4-(1-pyrenyl)butoxy)-, hydroxide, inner salt

Registry Numbers

CAS Registry Number

  • 81923-90-2

System Generated Number

  • 0081923902

Structure Descriptors

InChI

1S/C27H29NO4/c1-28(2,3)17-22(16-24(29)30)32-25(31)9-5-6-18-10-11-21-13-12-19-7-4-8-20-14-15-23(18)27(21)26(19)20/h4,7-8,10-15,22H,5-6,9,16-17H2,1-3H3

InChIKey

XLZUNRCLJXKEIE-UHFFFAOYSA-N

Smiles

C([C@@H](CC(=O)[O-])OC(CCCc1ccc2ccc3cccc4ccc1c2c34)=O)[N+](C)(C)C