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(1R,3R,4R,7R,8R,11S,13S)-3,4:7,8-Diepoxy-13-hydroxy-dolabell12(18)-ene

View entire compound with spectra: 1 MS (GC)

(1R,3R,4R,7R,8R,11S,13S)-3,4:7,8-Diepoxy-13-hydroxy-dolabell12(18)-ene
SpectraBase Compound ID Gcs154IbXdM
InChI InChI=1S/C20H32O3/c1-12(2)17-13-6-8-19(4)15(22-19)7-9-20(5)16(23-20)11-18(13,3)10-14(17)21/h13-16,21H,6-11H2,1-5H3/t13-,14+,15-,16-,18+,19-,20-/m1/s1
InChIKey LTBARYVDNOADAG-NHPMYSMKSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID f6S6wKJLKP
Name (1R,3R,4R,7R,8R,11S,13S)-3,4:7,8-Diepoxy-13-hydroxy-dolabell12(18)-ene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-12(2)17-13-6-8-19(4)15(22-19)7-9-20(5)16(23-20)11-18(13,3)10-14(17)21/h13-16,21H,6-11H2,1-5H3/t13-,14+,15-,16-,18+,19-,20-/m1/s1
InChIKey LTBARYVDNOADAG-NHPMYSMKSA-N
Instrument Name Agilent 5977A MSD
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.1c00199
Molecular Weight 320.473 g/mol
SMILES O[C@@]1(C([C@]2(CC[C@@]3([C@@](CC[C@@]4([C@@](C[C@@]2(C1)C)(O4)[H])C)(O3)[H])C)[H])=C(C)C)[H]
SPLASH splash10-053s-9600000000-047c8e8fd2621d1555b7
Source of Spectrum G4-84-1381-15
Wiley ID 1884147