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.beta.-D-Glucopyranosiduronic acid, 1,2-dihydro(methylthio)naphthalenyl 2,3,4-tris-O-(trimethylsilyl)-, trimethylsilyl ester
SpectraBase Compound ID 74RXr6WNnSC
InChI InChI=1S/C29H52O7SSi4/c1-37-22-19-18-20-16-14-15-17-21(20)23(22)31-29-27(35-40(8,9)10)25(34-39(5,6)7)24(33-38(2,3)4)26(32-29)28(30)36-41(11,12)13/h14-19,22-27,29H,1-13H3/t22?,23?,24-,25-,26-,27+,29+/m0/s1
InChIKey PEVGSRZYNXVIMD-LFORQPCTSA-N
Mol Weight 657.1 g/mol
Molecular Formula C29H52O7SSi4
Exact Mass 656.251081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lw3RNV4hkeO
Name .beta.-D-Glucopyranosiduronic acid, 1,2-dihydro(methylthio)naphthalenyl 2,3,4-tris-O-(trimethylsilyl)-, trimethylsilyl ester
CAS Registry Number 83228-91-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H52O7SSi4
InChI InChI=1S/C29H52O7SSi4/c1-37-22-19-18-20-16-14-15-17-21(20)23(22)31-29-27(35-40(8,9)10)25(34-39(5,6)7)24(33-38(2,3)4)26(32-29)28(30)36-41(11,12)13/h14-19,22-27,29H,1-13H3/t22?,23?,24-,25-,26-,27+,29+/m0/s1
InChIKey PEVGSRZYNXVIMD-LFORQPCTSA-N
Molecular Weight 657.128 g/mol
SMILES [C@]1([C@@]([C@@](O[Si](C)(C)C)([C@@](O[C@@]1(C(O[Si](C)(C)C)=O)[H])(OC1c2c(cccc2)C=CC1SC)[H])[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H]
SPLASH splash10-00fr-0900000000-8a389d4b74368cd6b9d6
Source of Spectrum KO-9-249-8
Synonyms 2-(methylsulfanyl)-1,2-dihydro-1-naphthalenyl trimethylsilyl 2,3,4-tris-O-(trimethylsilyl)-.beta.-D-glucopyranosiduronate Per(trimethylsilyl)derivative of dihydromethylthionaphtholyl monoglucuronide
Wiley ID 1413357