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

*Links on SpectraBase are not permalinks.

(1R,3R)-15-[(5S)-2,5-Dihydro-5-methyl-2-oxofuran-3-yl]-3-hydroxy-1-{(2R,5R)-5-[(1R)-1-hydroxytridecyl]tetrahydrofuran-2-yl}-13-oxopentadecyl Acetate

View entire compound with spectra: 1 MS (GC)

(1R,3R)-15-[(5S)-2,5-Dihydro-5-methyl-2-oxofuran-3-yl]-3-hydroxy-1-{(2R,5R)-5-[(1R)-1-hydroxytridecyl]tetrahydrofuran-2-yl}-13-oxopentadecyl Acetate
SpectraBase Compound ID Jdm0Qsk347w
InChI InChI=1S/C39H68O8/c1-4-5-6-7-8-9-10-14-17-20-23-35(43)36-26-27-37(47-36)38(46-31(3)40)29-34(42)22-19-16-13-11-12-15-18-21-33(41)25-24-32-28-30(2)45-39(32)44/h28,30,34-38,42-43H,4-27,29H2,1-3H3/t30-,34+,35+,36+,37+,38+/m0/s1
InChIKey BDOAVPGXBNUKRA-UVKIPMPFSA-N
Mol Weight 665.0 g/mol
Molecular Formula C39H68O8
Exact Mass 664.491419 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 1e3y45Cm7Is
Name (1R,3R)-15-[(5S)-2,5-Dihydro-5-methyl-2-oxofuran-3-yl]-3-hydroxy-1-{(2R,5R)-5-[(1R)-1-hydroxytridecyl]tetrahydrofuran-2-yl}-13-oxopentadecyl Acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H68O8
InChI InChI=1S/C39H68O8/c1-4-5-6-7-8-9-10-14-17-20-23-35(43)36-26-27-37(47-36)38(46-31(3)40)29-34(42)22-19-16-13-11-12-15-18-21-33(41)25-24-32-28-30(2)45-39(32)44/h28,30,34-38,42-43H,4-27,29H2,1-3H3/t30-,34+,35+,36+,37+,38+/m0/s1
InChIKey BDOAVPGXBNUKRA-UVKIPMPFSA-N
Molecular Weight 664.965 g/mol
SMILES O[C@@]([C@@]1(O[C@@]([C@@](C[C@](O)(CCCCCCCCCC(CCC=2C(O[C@](C2)(C)[H])=O)=O)[H])(OC(C)=O)[H])(CC1)[H])[H])(CCCCCCCCCCCC)[H]
SPLASH splash10-000i-0119100000-e943ffe6bfff7598eb3a
Source of Spectrum H-81-1614-2
Synonyms Sootepensin B (1R,3R)-3-hydroxy-1-((2R,5R)-5-((R)-1-hydroxytridecyl)tetrahydrofuran-2-yl)-15-((S)-5-methyl-2-oxo-2,5-dihydrofuran-3-yl)-13-oxopentadecyl acetate
Wiley ID 1785338