For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl ester of (+)-(5S,6S)-6-Hydroxy-5-trimethylsilyloxy-5,6-dihydro-10'-apo-.beta.-carotin-10'-oic acid
SpectraBase Compound ID 3aLWuB0xg09
InChI InChI=1S/C31H48O4Si/c1-25(15-11-16-26(2)19-13-20-28(32)34-7)17-12-18-27(3)21-24-31(35-36(8,9)10)29(4,5)22-14-23-30(31,6)33/h11-13,15-21,24,33H,14,22-23H2,1-10H3/b16-11+,17-12+,20-13+,24-21+,25-15+,26-19+,27-18+/t30-,31-/m0/s1
InChIKey GUTRKISJIIMNRG-SUYZWBICSA-N
Mol Weight 512.8 g/mol
Molecular Formula C31H48O4Si
Exact Mass 512.332187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GWByWI79R0i
Name Methyl ester of (+)-(5S,6S)-6-Hydroxy-5-trimethylsilyloxy-5,6-dihydro-10'-apo-.beta.-carotin-10'-oic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H48O4Si
InChI InChI=1S/C31H48O4Si/c1-25(15-11-16-26(2)19-13-20-28(32)34-7)17-12-18-27(3)21-24-31(35-36(8,9)10)29(4,5)22-14-23-30(31,6)33/h11-13,15-21,24,33H,14,22-23H2,1-10H3/b16-11+,17-12+,20-13+,24-21+,25-15+,26-19+,27-18+/t30-,31-/m0/s1
InChIKey GUTRKISJIIMNRG-SUYZWBICSA-N
Molecular Weight 512.806 g/mol
SMILES O[C@@]1([C@](\C=C\C(=C\C=C\C(=C\C=C\C(=C\C=C\C(=O)OC)C)C)C)(C(CCC1)(C)C)O[Si](C)(C)C)C
SPLASH splash10-05fu-9400000000-0ddaf7058715c6613ec4
Source of Spectrum H-65-362-0
Synonyms Methyl (2E,4E,6E,8E,10E,12E,14E)-15-{(1S,2S)-2-hydroxy-2,6,6-trimethyl-1-[(trimethylsilyl)oxy]cyclohexyl}-5,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoate
Wiley ID 1400876