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Substance Name: Tetrathermotaurine
RN: 143413-77-8
InChIKey: FIJLBEBGHVOOJE-UXBLZVDNSA-N

Molecular Formula

  • C20-H37-N-O7-S

Molecular Weight

  • 435.5783
 
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Names and Synonyms

Results Name

  • Tetrathermotaurine

Name of Substance

  • 2-(2,3-Dihyroxy-9,13-oxy-7-octadecenoylamino)ethanesulfonic acid

Synonyms

  • 2-((2,3-Dihydroxy-1-oxo-8-(tetrahydro-6-pentyl-2H-pyran-2-yl)-7-octenyl)amino)ethanesulfonic acid
  • 2-(2,3-Dihydroxy-9,13-oxy-7-trans-octadecenoylamino)ethanesulfonic acid
  • Tetrathermotaurine

Systematic Name

  • Ethanesulfonic acid, 2-((2,3-dihydroxy-1-oxo-8-(tetrahydro-6-pentyl-2H-pyran-2-yl)-7-octenyl)amino)-

Registry Numbers

CAS Registry Number

  • 143413-77-8

System Generated Number

  • 0143413778

Structure Descriptors

InChI

1S/C20H37NO7S/c1-2-3-5-9-16-11-8-12-17(28-16)10-6-4-7-13-18(22)19(23)20(24)21-14-15-29(25,26)27/h6,10,16-19,22-23H,2-5,7-9,11-15H2,1H3,(H,21,24)(H,25,26,27)/b10-6+

InChIKey

FIJLBEBGHVOOJE-UXBLZVDNSA-N

Smiles

CCCCCC1CCCC(O1)/C=C/CCCC(C(C(=O)NCCS(=O)(=O)O)O)O