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D-erythro-.alpha.-D-galacto-Octopyranoside, methyl 6-[[(4-butyl-1-ethyl-2-pyrrolidinyl)carbonyl]amino]-6,8-dideoxy-1-thio-, (2S-trans)-
SpectraBase Compound ID LnPFNXUXb14
InChI InChI=1S/C20H38N2O6S/c1-5-7-8-12-9-13(22(6-2)10-12)19(27)21-14(11(3)23)18-16(25)15(24)17(26)20(28-18)29-4/h11-18,20,23-26H,5-10H2,1-4H3,(H,21,27)/t11?,12-,13+,14+,15+,16-,17-,18?,20?/m1/s1
InChIKey BPVOWQVQKNAFIF-WFKQYXHLSA-N
Mol Weight 434.6 g/mol
Molecular Formula C20H38N2O6S
Exact Mass 434.245058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 102GbRYd9g
Name D-erythro-.alpha.-D-galacto-Octopyranoside, methyl 6-[[(4-butyl-1-ethyl-2-pyrrolidinyl)carbonyl]amino]-6,8-dideoxy-1-thio-, (2S-trans)-
Alternate Name(s) 4'-n butyl-N-ethyl lincomycin D-erythro-D-galacto-octopyranoside, methyl 6-(4-butyl-1-ethyl-L-2-pyrrolidinecarboxamido-6,8-dideoxy-1-thio-, trans- .alpha.- Methyl 6-({[(2S,4R)-4-butyl-1-ethylpyrrolidinyl]carbonyl}amino)-6,8-dideoxy-1-thio-L-altro-octopyranoside
CAS Registry Number 17057-68-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38N2O6S
InChI InChI=1S/C20H38N2O6S/c1-5-7-8-12-9-13(22(6-2)10-12)19(27)21-14(11(3)23)18-16(25)15(24)17(26)20(28-18)29-4/h11-18,20,23-26H,5-10H2,1-4H3,(H,21,27)/t11?,12-,13+,14+,15+,16-,17-,18?,20?/m1/s1
InChIKey BPVOWQVQKNAFIF-WFKQYXHLSA-N
Molecular Weight 434.592 g/mol
SMILES O[C@@]1([C@@]([C@](C(OC1[C@](C(O)C)(NC([C@]1(N(C[C@@](C1)(CCCC)[H])CC)[H])=O)[H])SC)(O)[H])(O)[H])[H]
SPLASH splash10-0udi-0900000000-df98b4f9e0026c05931e
Source of Spectrum OS-6-468-0
Wiley ID 1382865