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Substance Name: Leukotriene C-2
RN: 74841-69-3
InChIKey: KVSDCBWIPGWMGL-IQFOYCAVSA-N

Molecular Weight

  • 625.779
 
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Names and Synonyms

Name of Substance

  • Leukotriene C-2

Synonyms

  • 11-trans-Leukotriene
  • 5(S)-Hydroxy-6(R)-S-glutathionyl-7,9,11-trans-14-cis-eicosatetraenoic acid

Systematic Name

  • Glycine, N-(S-(1-(4-carboxy-1-hydroxybutyl)-2,4,6,9-pentadecatetraenyl)-N-L-gamma-glutamyl-L-cysteinyl)-, (R-(R*,S*-(E,E,E,Z)))-

Registry Numbers

CAS Registry Number

  • 74841-69-3

System Generated Number

  • 0074841693

Structure Descriptors

InChI

1S/C30H47N3O9S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25(24(34)15-14-17-27(36)37)43-21-23(32)29(40)33(20-28(38)39)26(35)19-18-22(31)30(41)42/h6-7,9-13,16,22-25,34H,2-5,8,14-15,17-21,31-32H2,1H3,(H,36,37)(H,38,39)(H,41,42)/b7-6-,10-9+,12-11+,16-13+/t22-,23-,24-,25?/m0/s1

InChIKey

KVSDCBWIPGWMGL-IQFOYCAVSA-N

Smiles

C(CN(C([C@@H](N)CS[C@@H](\C=C\C=C\C=C\C\C=C/CCCCC)[C@H](CCCC(=O)O)O)=O)C(CC[C@H](N)C(=O)O)=O)(=O)O