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(3S,5R,6R,3'S)-5-O-Trimethylsilyl-3,6-epoxy-5,6-dihydro-.beta.,.beta.-carotene-5,3'-diol
SpectraBase Compound ID ES2YCRo6qlS
InChI InChI=1S/C43H64O3Si/c1-32(20-16-22-34(3)24-25-39-36(5)28-37(44)29-40(39,6)7)18-14-15-19-33(2)21-17-23-35(4)26-27-43-41(8,9)30-38(45-43)31-42(43,10)46-47(11,12)13/h14-27,37-38,44H,28-31H2,1-13H3/b15-14+,20-16+,21-17+,25-24+,27-26+,32-18+,33-19+,34-22+,35-23+/t37-,38-,42+,43+/m0/s1
InChIKey CYVCVFFFXZFSTQ-ZLCMQPKISA-N
Mol Weight 657.1 g/mol
Molecular Formula C43H64O3Si
Exact Mass 656.462472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhsS2ueucnd
Name (3S,5R,6R,3'S)-5-O-Trimethylsilyl-3,6-epoxy-5,6-dihydro-.beta.,.beta.-carotene-5,3'-diol
Alternate Name(s) (1S)-3,5,5-trimethyl-4-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-{(1R,4S,6R)-2,2,6-trimethyl-6-[(trimethylsilyl)oxy]-7-oxabicyclo[2.2.1]hept-1-yl}-1,3,5,7,9,11,13,15,17-octadecanonaenyl)-3-cyclohexen-1-ol
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Formula C43H64O3Si
InChI InChI=1S/C43H64O3Si/c1-32(20-16-22-34(3)24-25-39-36(5)28-37(44)29-40(39,6)7)18-14-15-19-33(2)21-17-23-35(4)26-27-43-41(8,9)30-38(45-43)31-42(43,10)46-47(11,12)13/h14-27,37-38,44H,28-31H2,1-13H3/b15-14+,20-16+,21-17+,25-24+,27-26+,32-18+,33-19+,34-22+,35-23+/t37-,38-,42+,43+/m0/s1
InChIKey CYVCVFFFXZFSTQ-ZLCMQPKISA-N
Molecular Weight 657.067 g/mol
SMILES O[C@@]1(CC(C(\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\[C@]23[C@@](C[C@@](O3)(CC2(C)C)[H])(O[Si](C)(C)C)C)C)C)C)C)=C(C1)C)(C)C)[H]
SPLASH splash10-0a4i-0220009000-1511c7cd601484147423
Source of Spectrum H-76-955-1
Wiley ID 1413392