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5-[4-[N-[(3R/S)-5-Benzyloxy-2,3-dihydroxy-2,2,4,6,7-pentametylbenzofuran-3-ylmethyl]-(2S)-pyrrolidin-2-ylmethoxy]phenylmethyl]-2,4-thiazolidindione
SpectraBase Compound ID GsL4H4EBYEX
InChI InChI=1S/C36H42N2O5S/c1-22-23(2)33-31(24(3)32(22)42-20-26-10-7-6-8-11-26)29(36(4,5)43-33)19-38-17-9-12-27(38)21-41-28-15-13-25(14-16-28)18-30-34(39)37-35(40)44-30/h6-8,10-11,13-16,27,29-30H,9,12,17-21H2,1-5H3,(H,37,39,40)/t27-,29?,30?/m0/s1
InChIKey VDGCNOYTIPMBBA-MQPDAGPXSA-N
Mol Weight 614.8 g/mol
Molecular Formula C36H42N2O5S
Exact Mass 614.281444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IqdROzeq9z
Name 5-[4-[N-[(3R/S)-5-Benzyloxy-2,3-dihydroxy-2,2,4,6,7-pentametylbenzofuran-3-ylmethyl]-(2S)-pyrrolidin-2-ylmethoxy]phenylmethyl]-2,4-thiazolidindione
Alternate Name(s) 5-[4-[N-[(3R/S)-2,3-Dihydro-5-benzyloxy-2,2,4,6,7-pentamethylbenzofuran-3-ylmethyl)-(2S)-pyrrolidin-2-ylmethoxy]phenylmethyl]-2,4-thiazolidindione 5-[[4-[[(2S)-1-[(2,2,4,6,7-pentamethyl-5-phenylmethoxy-3H-benzofuran-3-yl)methyl]-2-pyrrolidinyl]methoxy]phenyl]methyl]thiazolidine-2,4-dione 5-[[4-[[(2S)-1-[(5-benzyloxy-2,2,4,6,7-pentamethyl-3H-benzofuran-3-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]methyl]thiazolidine-2,4-dione 5-[[4-[[(2S)-1-[(2,2,4,6,7-pentamethyl-5-phenylmethoxy-3H-1-benzofuran-3-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
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Formula C36H42N2O5S
InChI InChI=1S/C36H42N2O5S/c1-22-23(2)33-31(24(3)32(22)42-20-26-10-7-6-8-11-26)29(36(4,5)43-33)19-38-17-9-12-27(38)21-41-28-15-13-25(14-16-28)18-30-34(39)37-35(40)44-30/h6-8,10-11,13-16,27,29-30H,9,12,17-21H2,1-5H3,(H,37,39,40)/t27-,29?,30?/m0/s1
InChIKey VDGCNOYTIPMBBA-MQPDAGPXSA-N
Molecular Weight 614.801 g/mol
SMILES N1C(SC(C1=O)Cc1ccc(OC[C@]2(N(CC3c4c(OC3(C)C)c(C)c(c(c4C)OCc3ccccc3)C)CCC2)[H])cc1)=O
SPLASH splash10-0a4i-0019000000-f52592fdece79e7128c4
Source of Spectrum F2-42-1938-19
Wiley ID 1600196