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

SpectraBase Compound ID	JvPQTg7AX0f
InChI	InChI=1S/C29H34N2O5S/c1-17-18(2)26-23(19(3)25(17)32)11-12-29(4,36-26)16-31-13-5-6-21(31)15-35-22-9-7-20(8-10-22)14-24-27(33)30-28(34)37-24/h7-10,14,21,32H,5-6,11-13,15-16H2,1-4H3,(H,30,33,34)/b24-14-/t21-,29?/m0/s1
InChIKey	YZKDSEWVOOJDTJ-ORUWBHDGSA-N Google Search
Mol Weight	522.7 g/mol
Molecular Formula	C29H34N2O5S
Exact Mass	522.218843 g/mol

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SpectraBase Spectrum ID	LmvLS9nQdq6
Name	5-[4-[N-[(2R/S)-6-Hydroxy-2,5,7,8-tetramethylchroman-2-ylmethyl]-(2S)-pyrrolidine-2-methoxy]phenylmethylene]thiazolidine-2,4-dione
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H34N2O5S
InChI	InChI=1S/C29H34N2O5S/c1-17-18(2)26-23(19(3)25(17)32)11-12-29(4,36-26)16-31-13-5-6-21(31)15-35-22-9-7-20(8-10-22)14-24-27(33)30-28(34)37-24/h7-10,14,21,32H,5-6,11-13,15-16H2,1-4H3,(H,30,33,34)/b24-14-/t21-,29?/m0/s1
InChIKey	YZKDSEWVOOJDTJ-ORUWBHDGSA-N
Molecular Weight	522.660 g/mol
SMILES	N1C(\C(=C\c2ccc(OC[C@]3(N(CC4(CCc5c(c(c(c(c5O4)C)C)O)C)C)CCC3)[H])cc2)SC1=O)=O
SPLASH	splash10-014i-0009000000-5f2d268f019c3e972f40
Source of Spectrum	F2-42-3276-15
Synonyms	(5Z)-5-[[4-[[(2S)-1-[(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl)methyl]-2-pyrrolidinyl]methoxy]phenyl]methylidene]thiazolidine-2,4-dione (5Z)-5-[[4-[[(2S)-1-[(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione (5Z)-5-[[4-[[(2S)-1-[(6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]methylene]thiazolidine-2,4-dione (5Z)-5-[[4-[[(2S)-1-[(2,5,7,8-tetramethyl-6-oxidanyl-3,4-dihydrochromen-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione
Wiley ID	1600307