Chem
J-GLOBAL ID：201707000646395510   Nikkaji number：J3.579.650I

Garlicnin I1

ガルリクニンI1
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C13H22[O-]S4[S+]
Molecular formula furigana： C13-H22-O-S5
Molecular weight： 354.620
InChI： InChI=1S/C13H22OS5/c1-4-6-15-17-9-12-8-11(3)19(14)13(12)10-18-16-7-5-2/h4-5,11-13H,1-2,6-10H2,3H3/t11?,12-,13+,19?/m0/s1
InChI key： QSRWFPFBNJZETK-FNWIOWCISA-N
SMILES： CC1C[C@@H](CSSCC=C)[C@@H](CSSCC=C)[S+]1[O-]
Systematic name  (3)：
  • (2S,3S)-1-オキシラト-2,3-ビス(アリルジチオメチル)-5-メチルテトラヒドロチオフェン-1-イウム
  • (2S,3S)-5-メチル-2,3-ビス[(プロパ-2-エン-1-イルジスルファニル)メチル]チオラン-1-イウム-1-オラート
  • (2S,3S)-5-methyl-2,3-bis[(prop-2-en-1-yldisulfanyl)methyl]thiolan-1-ium-1-olate
Other name (3)：
  • (2S,3S)-1-Oxylato-2,3-bis(allyldithiomethyl)-5-methyltetrahydrothiophene-1-ium
  • ガルリクニンI1
  • Garlicnin I1
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