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

*Links on SpectraBase are not permalinks.
(2S)-2-methyl-4-[(2R)-2-oxidanyl-7-[(2R,5S)-5-[(2S,5S)-5-[(1S)-1-oxidanylpentadecyl]oxolan-2-yl]oxolan-2-yl]heptyl]-2H-furan-5-one
SpectraBase Compound ID rPLIypETuo
InChI InChI=1S/C35H62O6/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(37)32-23-24-34(41-32)33-22-21-30(40-33)19-16-14-15-18-29(36)26-28-25-27(2)39-35(28)38/h25,27,29-34,36-37H,3-24,26H2,1-2H3/t27-,29+,30+,31-,32-,33-,34-/m0/s1
InChIKey ICSXGOKNISTZTO-GCCZPAPFSA-N
Mol Weight 578.9 g/mol
Molecular Formula C35H62O6
Exact Mass 578.45464 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 4fiNoG70abp
Name (2S)-2-methyl-4-[(2R)-2-oxidanyl-7-[(2R,5S)-5-[(2S,5S)-5-[(1S)-1-oxidanylpentadecyl]oxolan-2-yl]oxolan-2-yl]heptyl]-2H-furan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H62O6
InChI InChI=1S/C35H62O6/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(37)32-23-24-34(41-32)33-22-21-30(40-33)19-16-14-15-18-29(36)26-28-25-27(2)39-35(28)38/h25,27,29-34,36-37H,3-24,26H2,1-2H3/t27-,29+,30+,31-,32-,33-,34-/m0/s1
InChIKey ICSXGOKNISTZTO-GCCZPAPFSA-N
Molecular Weight 578.875 g/mol
SMILES O[C@](CCCCC[C@]1(O[C@]([C@]2(O[C@]([C@@](O)(CCCCCCCCCCCCCC)[H])(CC2)[H])[H])(CC1)[H])[H])(CC=1C(O[C@](C1)(C)[H])=O)[H]
SPLASH splash10-01t9-0000090000-c07d34afdfeab605d3bf
Source of Spectrum U1-2000-354-1
Synonyms (2S)-4-[(2R)-2-hydroxy-7-[(2R,5S)-5-[(2S,5S)-5-[(1S)-1-hydroxypentadecyl]-2-oxolanyl]-2-oxolanyl]heptyl]-2-methyl-2H-furan-5-one (2S)-4-[(2R)-2-hydroxy-7-[(2R,5S)-5-[(2S,5S)-5-[(1S)-1-hydroxypentadecyl]oxolan-2-yl]oxolan-2-yl]heptyl]-2-methyl-2H-furan-5-one (2S)-4-[(2R)-2-hydroxy-7-[(2R,5S)-5-[(2S,5S)-5-[(1S)-1-hydroxypentadecyl]tetrahydrofuran-2-yl]tetrahydrofuran-2-yl]heptyl]-2-methyl-2H-furan-5-one
Wiley ID 753806