Chem
J-GLOBAL ID：200907004811782802   Nikkaji number：J2.394.197J

3β-(3,5-Dimethoxy-4-hydroxybenzyl)-4α-[α,α-bis(phenylthio)-3-hydroxy-4-isopropoxybenzyl]-4,5-dihydrofuran-2(3H)-one

3β-(3,5-ジメトキシ-4-ヒドロキシベンジル)-4α-[α,α-ビス(フェニルチオ)-3-ヒドロキシ-4-イソプロポキシベンジル]-4,5-ジヒドロフラン-2(3H)-オン
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： C35H36O7S2
Molecular formula furigana： C35-H36-O7-S2
Molecular weight： 632.790
InChI： InChI=1S/C35H36O7S2/c1-22(2)42-30-16-15-24(20-29(30)36)35(43-25-11-7-5-8-12-25,44-26-13-9-6-10-14-26)28-21-41-34(38)27(28)17-23-18-31(39-3)33(37)32(19-23)40-4/h5-16,18-20,22,27-28,36-37H,17,21H2,1-4H3/t27-,28+/m0/s1
InChI key： CJBPZOPPPFPPNL-WUFINQPMSA-N
SMILES： COc1cc(C[C@H]2[C@@H](COC2=O)C(Sc2ccccc2)(Sc2ccccc2)c2ccc(OC(C)C)c(O)c2)cc(OC)c1O
Systematic name  (3)：
  • 3β-(3,5-ジメトキシ-4-ヒドロキシベンジル)-4α-[α,α-ビス(フェニルチオ)-3-ヒドロキシ-4-イソプロポキシベンジル]-4,5-ジヒドロフラン-2(3H)-オン
  • (3S,4S)-3-[(4-ヒドロキシ-3,5-ジメトキシフェニル)メチル]-4-{[3-ヒドロキシ-4-(プロパン-2-イルオキシ)フェニル]ビス(フェニルスルファニル)メチル}オキソラン-2-オン
  • (3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-{[3-hydroxy-4-(propan-2-yloxy)phenyl]bis(phenylsulfanyl)methyl}oxolan-2-one
Other name (1)：
  • 3β-(3,5-Dimethoxy-4-hydroxybenzyl)-4α-[α,α-bis(phenylthio)-3-hydroxy-4-isopropoxybenzyl]-4,5-dihydrofuran-2(3H)-one
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