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(S)-N-(2S,3S,4S,6R)-7-(4-Methoxybenzyloxy)-4,6-dimethyl-3-hydroxy-2-ethylheptanoyl]-4-isopropyloxazolidine-2-thione
SpectraBase Compound ID 151qiPoyrD5
InChI InChI=1S/C25H39NO5S/c1-7-21(24(28)26-22(16(2)3)15-31-25(26)32)23(27)18(5)12-17(4)13-30-14-19-8-10-20(29-6)11-9-19/h8-11,16-18,21-23,27H,7,12-15H2,1-6H3/t17-,18+,21-,22-,23+/m1/s1
InChIKey TVNWWQUAHUHZOE-DDFUWSPLSA-N
Mol Weight 465.6 g/mol
Molecular Formula C25H39NO5S
Exact Mass 465.254895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjmNycxXKMV
Name (S)-N-(2S,3S,4S,6R)-7-(4-Methoxybenzyloxy)-4,6-dimethyl-3-hydroxy-2-ethylheptanoyl]-4-isopropyloxazolidine-2-thione
Alternate Name(s) (4S)-3-{(3S,4S,6R)-2-ethyl-3-hydroxy-7-[(4-methoxybenzyl)oxy]-4,6-dimethylheptanoyl}-4-isopropyl-1,3-oxazolidine-2-thione (2R,3S,4S,6R)-2-ethyl-3-hydroxy-7-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-1-[(4S)-4-propan-2-yl-2-sulfanylidene-3-oxazolidinyl]-1-heptanone (2R,3S,4S,6R)-2-ethyl-3-hydroxy-7-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-1-[(4S)-4-propan-2-yl-2-sulfanylidene-1,3-oxazolidin-3-yl]heptan-1-one (2R,3S,4S,6R)-2-ethyl-3-hydroxy-1-[(4S)-4-isopropyl-2-thioxo-oxazolidin-3-yl]-7-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-heptan-1-one (2R,3S,4S,6R)-2-ethyl-7-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-oxidanyl-1-[(4S)-4-propan-2-yl-2-sulfanylidene-1,3-oxazolidin-3-yl]heptan-1-one
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Formula C25H39NO5S
InChI InChI=1S/C25H39NO5S/c1-7-21(24(28)26-22(16(2)3)15-31-25(26)32)23(27)18(5)12-17(4)13-30-14-19-8-10-20(29-6)11-9-19/h8-11,16-18,21-23,27H,7,12-15H2,1-6H3/t17-,18+,21-,22-,23+/m1/s1
InChIKey TVNWWQUAHUHZOE-DDFUWSPLSA-N
Molecular Weight 465.649 g/mol
SMILES O[C@]([C@](C(N1C(OC[C@@]1(C(C)C)[H])=S)=O)(CC)[H])([C@](C[C@](COCc1ccc(cc1)OC)(C)[H])(C)[H])[H]
SPLASH splash10-00di-0910000000-23b9f415c03669a0fcdf
Source of Spectrum KC-0-33-104
Wiley ID 824151