Chem
J-GLOBAL ID：200907084117890103
Nikkaji number：J1.853.934I
6-[[5-(Methylthio)-4′,5′-bis(pentylthio)-Δ2,2′-bi[1,3-dithiol]-4-yl]thio]hexanoic acid
6-[[5-(メチルチオ)-4′,5′-ビス(ペンチルチオ)-Δ2,2′-ビ[1,3-ジチオール]-4-イル]チオ]ヘキサン酸
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
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
Molecular formula： C23H36O2S8
Molecular formula furigana： C23-H36-O2-S8
Molecular weight： 601.020
InChI：
InChI=1S/C23H36O2S8/c1-4-6-10-14-28-20-21(29-15-11-7-5-2)33-23(32-20)22-30-18(26-3)19(31-22)27-16-12-8-9-13-17(24)25/h4-16H2,1-3H3,(H,24,25)
InChI key：
WQJVWLJSPVPGLB-UHFFFAOYSA-N
SMILES：
CCCCCSC1=C(SCCCCC)S/C(=C/2\SC(=C(SCCCCCC(=O)O)S2)SC)/S1
Systematic name (3)：
- 6-[[5-(メチルチオ)-4′,5′-ビス(ペンチルチオ)-Δ2,2′-ビ[1,3-ジチオール]-4-イル]チオ]ヘキサン酸
- 6-({2-[4,5-ビス(ペンチルスルファニル)-2H-1,3-ジチオール-2-イリデン]-5-(メチルスルファニル)-2H-1,3-ジチオール-4-イル}スルファニル)ヘキサン酸
- 6-({2-[4,5-bis(pentylsulfanyl)-2H-1,3-dithiol-2-ylidene]-5-(methylsulfanyl)-2H-1,3-dithiol-4-yl}sulfanyl)hexanoic acid
- 6-[[5-(Methylthio)-4′,5′-bis(pentylthio)-Δ2,2′-bi[1,3-dithiol]-4-yl]thio]hexanoic acid
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