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.alpha.-DL-lyxo-Hexopyranoside, methyl 4,6-dideoxy-6-[[[1-[(phenylmethoxy)carbonyl]-2-pyrrolidinyl]carbonyl]amino]-1-thio-, 3-benzoate
SpectraBase Compound ID 107NoQ91Fj5
InChI InChI=1S/C27H32N2O7S/c1-37-26-23(30)22(36-25(32)19-11-6-3-7-12-19)15-20(35-26)16-28-24(31)21-13-8-14-29(21)27(33)34-17-18-9-4-2-5-10-18/h2-7,9-12,20-23,26,30H,8,13-17H2,1H3,(H,28,31)
InChIKey RXZNSUXJKKOECN-UHFFFAOYSA-N
Mol Weight 528.6 g/mol
Molecular Formula C27H32N2O7S
Exact Mass 528.193023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LncftWLrg2b
Name .alpha.-DL-lyxo-Hexopyranoside, methyl 4,6-dideoxy-6-[[[1-[(phenylmethoxy)carbonyl]-2-pyrrolidinyl]carbonyl]amino]-1-thio-, 3-benzoate
CAS Registry Number 70835-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32N2O7S
InChI InChI=1S/C27H32N2O7S/c1-37-26-23(30)22(36-25(32)19-11-6-3-7-12-19)15-20(35-26)16-28-24(31)21-13-8-14-29(21)27(33)34-17-18-9-4-2-5-10-18/h2-7,9-12,20-23,26,30H,8,13-17H2,1H3,(H,28,31)
InChIKey RXZNSUXJKKOECN-UHFFFAOYSA-N
Molecular Weight 528.620 g/mol
SMILES N(CC1CC(C(C(O1)SC)O)OC(c1ccccc1)=O)C(C1CCCN1C(=O)OCc1ccccc1)=O
SPLASH splash10-000f-9330000000-143ccac6224391437bfc
Source of Spectrum W5-0-0-0
Synonyms (phenylmethyl) 2-[[6-methylsulfanyl-5-oxidanyl-4-(phenylcarbonyloxy)oxan-2-yl]methylcarbamoyl]pyrrolidine-1-carboxylate 2-[[4-benzoyloxy-5-hydroxy-6-(methylthio)tetrahydropyran-2-yl]methylcarbamoyl]pyrrolidine-1-carboxylic acid benzyl ester 2-[[[4-benzoyloxy-5-hydroxy-6-(methylthio)-2-oxanyl]methylamino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester benzyl 2-[(4-benzoyloxy-5-hydroxy-6-methylsulfanyl-tetrahydropyran-2-yl)methylcarbamoyl]pyrrolidine-1-carboxylate
Wiley ID 1403043