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5-Octenoic acid, 8-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-8-[tetrahydro-4-hydroxy-5-(3-oxo-1-octenyl)-2-furanyl]-, methyl ester, [2S-[2.alpha.(5Z,8S*),4.beta.,5.alpha.(E)]]-
SpectraBase Compound ID 4OgleVnmYeX
InChI InChI=1S/C37H52O6Si/c1-6-7-12-19-29(38)26-27-33-32(39)28-35(42-33)34(24-17-8-9-18-25-36(40)41-5)43-44(37(2,3)4,30-20-13-10-14-21-30)31-22-15-11-16-23-31/h8,10-11,13-17,20-23,26-27,32-35,39H,6-7,9,12,18-19,24-25,28H2,1-5H3/b17-8-,27-26+/t32-,33+,34-,35+/m1/s1
InChIKey APCDMLPCGORLCK-FDWQLQJTSA-N
Mol Weight 620.9 g/mol
Molecular Formula C37H52O6Si
Exact Mass 620.353316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID v5k5RdOgRJ
Name 5-Octenoic acid, 8-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-8-[tetrahydro-4-hydroxy-5-(3-oxo-1-octenyl)-2-furanyl]-, methyl ester, [2S-[2.alpha.(5Z,8S*),4.beta.,5.alpha.(E)]]-
Alternate Name(s) Methyl (5Z,8R)-8-{[tert-butyl(diphenyl)silyl]oxy}-8-{(2S,4R,5S)-4-hydroxy-5-[(1E)-3-oxo-1-octenyl]tetrahydro-2-furanyl}-5-octenoate Methyl 8R-tert-butyldiphenylsilyloxy-11R-hydroxy-15-oxo-9s,12S-oxyeicosa-5z,13e-dienoate
CAS Registry Number 80126-58-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H52O6Si
InChI InChI=1S/C37H52O6Si/c1-6-7-12-19-29(38)26-27-33-32(39)28-35(42-33)34(24-17-8-9-18-25-36(40)41-5)43-44(37(2,3)4,30-20-13-10-14-21-30)31-22-15-11-16-23-31/h8,10-11,13-17,20-23,26-27,32-35,39H,6-7,9,12,18-19,24-25,28H2,1-5H3/b17-8-,27-26+/t32-,33+,34-,35+/m1/s1
InChIKey APCDMLPCGORLCK-FDWQLQJTSA-N
Molecular Weight 620.902 g/mol
SMILES O[C@@]1(C[C@](O[C@]1(\C=C\C(=O)CCCCC)[H])([C@](O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)(C\C=C/CCCC(=O)OC)[H])[H])[H]
SPLASH splash10-000b-1900010000-0481a0a55666f45eb7b2
Source of Spectrum I-59-2735-0
Wiley ID 1411565