5-[4-[N-[(2R/S)-(6-Benzyloxy-2,5,7,8-tetramethylchroman-2-ylmethyl)-(2S)-pyrrolidine-2-methoxy]phenylmethyl]thiazolidine-2,4-dione

SpectraBase Compound ID	4kIgALjbbX4
InChI	InChI=1S/C36H42N2O5S/c1-23-24(2)33-30(25(3)32(23)42-20-27-9-6-5-7-10-27)16-17-36(4,43-33)22-38-18-8-11-28(38)21-41-29-14-12-26(13-15-29)19-31-34(39)37-35(40)44-31/h5-7,9-10,12-15,28,31H,8,11,16-22H2,1-4H3,(H,37,39,40)/t28-,31?,36?/m0/s1
InChIKey	NSEGOJXLVQTIAC-GNDAZDRNSA-N Google Search
Mol Weight	614.8 g/mol
Molecular Formula	C36H42N2O5S
Exact Mass	614.281444 g/mol

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SpectraBase Spectrum ID	CLbiKjnyA0f
Name	5-[4-[N-[(2R/S)-(6-Benzyloxy-2,5,7,8-tetramethylchroman-2-ylmethyl)-(2S)-pyrrolidine-2-methoxy]phenylmethyl]thiazolidine-2,4-dione
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C36H42N2O5S
InChI	InChI=1S/C36H42N2O5S/c1-23-24(2)33-30(25(3)32(23)42-20-27-9-6-5-7-10-27)16-17-36(4,43-33)22-38-18-8-11-28(38)21-41-29-14-12-26(13-15-29)19-31-34(39)37-35(40)44-31/h5-7,9-10,12-15,28,31H,8,11,16-22H2,1-4H3,(H,37,39,40)/t28-,31?,36?/m0/s1
InChIKey	NSEGOJXLVQTIAC-GNDAZDRNSA-N
Molecular Weight	614.801 g/mol
SMILES	N1C(C(SC1=O)Cc1ccc(OC[C@]2(N(CC3(Oc4c(c(C)c(c(c4CC3)C)OCc3ccccc3)C)C)CCC2)[H])cc1)=O
SPLASH	splash10-0006-0009000000-91b454e1ad8b099a7ce0
Source of Spectrum	F2-42-3276-20
Synonyms	5-[[4-[[(2S)-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-2-yl)methyl]-2-pyrrolidinyl]methoxy]phenyl]methyl]thiazolidine-2,4-dione 5-[[4-[[(2S)-1-[(6-benzyloxy-2,5,7,8-tetramethyl-chroman-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]methyl]thiazolidine-2,4-dione 5-[[4-[[(2S)-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Wiley ID	1600263