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.alpha.-DL-lyxo-Hexopyranoside, methyl 4,6-dideoxy-6-[[[1-[(phenylmethoxy)carbonyl]-2-pyrrolidinyl]carbonyl]amino]-1-thio-, 2,3-dibenzoate
SpectraBase Compound ID 7w170rJYF4S
InChI InChI=1S/C34H36N2O8S/c1-45-33-29(44-32(39)25-16-9-4-10-17-25)28(43-31(38)24-14-7-3-8-15-24)20-26(42-33)21-35-30(37)27-18-11-19-36(27)34(40)41-22-23-12-5-2-6-13-23/h2-10,12-17,26-29,33H,11,18-22H2,1H3,(H,35,37)
InChIKey IDCROGZQLMLGFW-UHFFFAOYSA-N
Mol Weight 632.7 g/mol
Molecular Formula C34H36N2O8S
Exact Mass 632.219237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HB6MhEIQqOQ
Name .alpha.-DL-lyxo-Hexopyranoside, methyl 4,6-dideoxy-6-[[[1-[(phenylmethoxy)carbonyl]-2-pyrrolidinyl]carbonyl]amino]-1-thio-, 2,3-dibenzoate
CAS Registry Number 70835-98-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H36N2O8S
InChI InChI=1S/C34H36N2O8S/c1-45-33-29(44-32(39)25-16-9-4-10-17-25)28(43-31(38)24-14-7-3-8-15-24)20-26(42-33)21-35-30(37)27-18-11-19-36(27)34(40)41-22-23-12-5-2-6-13-23/h2-10,12-17,26-29,33H,11,18-22H2,1H3,(H,35,37)
InChIKey IDCROGZQLMLGFW-UHFFFAOYSA-N
Molecular Weight 632.728 g/mol
SMILES N(CC1CC(C(C(O1)SC)OC(c1ccccc1)=O)OC(c1ccccc1)=O)C(C1CCCN1C(=O)OCc1ccccc1)=O
SPLASH splash10-0596-9500000000-d29dfb2e1beee82b4197
Source of Spectrum W5-0-0-0
Synonyms (phenylmethyl) 2-[[6-methylsulfanyl-4,5-bis(phenylcarbonyloxy)oxan-2-yl]methylcarbamoyl]pyrrolidine-1-carboxylate 2-[[4,5-dibenzoyloxy-6-(methylthio)tetrahydropyran-2-yl]methylcarbamoyl]pyrrolidine-1-carboxylic acid benzyl ester 2-[[[4,5-dibenzoyloxy-6-(methylthio)-2-oxanyl]methylamino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester benzyl 2-[(4,5-dibenzoyloxy-6-methylsulfanyl-tetrahydropyran-2-yl)methylcarbamoyl]pyrrolidine-1-carboxylate benzyl 2-[(4,5-dibenzoyloxy-6-methylsulfanyloxan-2-yl)methylcarbamoyl]pyrrolidine-1-carboxylate
Wiley ID 1412188