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D-erythro-.alpha.-D-galacto-Octopyranoside, methyl 6,8-dideoxy-6-[[(4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, (2S-trans)-

View entire compound with spectra: 1 MS (GC)

D-erythro-.alpha.-D-galacto-Octopyranoside, methyl 6,8-dideoxy-6-[[(4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, (2S-trans)-
SpectraBase Compound ID 5UV8i49aknJ
InChI InChI=1S/C17H32N2O6S/c1-4-5-9-6-10(18-7-9)16(24)19-11(8(2)20)15-13(22)12(21)14(23)17(25-15)26-3/h8-15,17-18,20-23H,4-7H2,1-3H3,(H,19,24)/t8-,9-,10+,11-,12+,13-,14-,15-,17-/m1/s1
InChIKey DKHKYHYYYGYWHY-AVXYAQEDSA-N
Mol Weight 392.5 g/mol
Molecular Formula C17H32N2O6S
Exact Mass 392.198108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8aKNBTA22Vh
Name D-erythro-.alpha.-D-galacto-Octopyranoside, methyl 6,8-dideoxy-6-[[(4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, (2S-trans)-
CAS Registry Number 2256-16-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H32N2O6S
InChI InChI=1S/C17H32N2O6S/c1-4-5-9-6-10(18-7-9)16(24)19-11(8(2)20)15-13(22)12(21)14(23)17(25-15)26-3/h8-15,17-18,20-23H,4-7H2,1-3H3,(H,19,24)/t8-,9-,10+,11-,12+,13-,14-,15-,17-/m1/s1
InChIKey DKHKYHYYYGYWHY-AVXYAQEDSA-N
Molecular Weight 392.511 g/mol
SMILES O[C@@]1([C@@]([C@]([C@](O[C@@]1([C@@]([C@](O)(C)[H])(NC([C@]1(NC[C@@](C1)(CCC)[H])[H])=O)[H])[H])(SC)[H])(O)[H])(O)[H])[H]
SPLASH splash10-03di-0900000000-6c0908788a491027413f
Source of Spectrum O6-0-1217-0
Synonyms D-erythro-D-galacto-octopyranoside, methyl 6,8-dideoxy-6-(4-propyl-L-2-pyrrolidinecarboxamido)-1-thio-, trans- .alpha.- Lincomycin D Methyl 6,8-dideoxy-6-({[(2S,4R)-4-propylpyrrolidinyl]carbonyl}amino)-1-thio-D-erythro-.alpha.-D-galacto-octopyranoside N-Demethyl lincomycin (2S,4R)-N-[(1R,2R)-2-hydroxy-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylthio)-2-oxanyl]propyl]-4-propyl-2-pyrrolidinecarboxamide (2S,4R)-N-[(1R,2R)-2-hydroxy-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-4-propylpyrrolidine-2-carboxamide (2S,4R)-N-[(1R,2R)-2-hydroxy-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl]propyl]-4-propyl-pyrrolidine-2-carboxamide (2S,4R)-N-[(1R,2R)-1-[(2R,3R,4S,5R,6R)-6-methylsulfanyl-3,4,5-tris(oxidanyl)oxan-2-yl]-2-oxidanyl-propyl]-4-propyl-pyrrolidine-2-carboxamide ANTIBIOTIC U 11973E
Wiley ID 1365630