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(14S)-8,13;14,15-DIEPOXYLABDANE-7-BETA-OL

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(14S)-8,13;14,15-DIEPOXYLABDANE-7-BETA-OL
SpectraBase Compound ID CuaBepR9yBJ
InChI InChI=1S/C20H34O3/c1-17(2)8-6-9-18(3)13-7-10-19(4,16-12-22-16)23-20(13,5)15(21)11-14(17)18/h13-16,21H,6-12H2,1-5H3/t13-,14+,15+,16+,18-,19-,20+/m1/s1
InChIKey PYZXQJNHQKDRES-IHAQYFQTSA-N
Mol Weight 322.5 g/mol
Molecular Formula C20H34O3
Exact Mass 322.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJlQDZmi5i5
Name (3R,4aS,5S,6aS,10aS,10bR)-3,4a,7,7,10a-pentamethyl-3-[(2S)-2-oxiranyl]-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f][1]benzopyran-5-ol
Alternate Name(s) (3R,4aS,5S,6aS,10aS,10bR)-3,4a,7,7,10a-pentamethyl-3-[(2S)-oxiran-2-yl]-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-5-ol
CAS Registry Number 76549-13-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-17(2)8-6-9-18(3)13-7-10-19(4,16-12-22-16)23-20(13,5)15(21)11-14(17)18/h13-16,21H,6-12H2,1-5H3/t13-,14+,15+,16+,18-,19-,20+/m1/s1
InChIKey PYZXQJNHQKDRES-IHAQYFQTSA-N
Molecular Weight 322.489 g/mol
SMILES O[C@@]1([C@]2(O[C@]([C@]3(OC3)[H])(C)CC[C@@]2([C@]2(CCCC([C@@]2(C1)[H])(C)C)C)[H])C)[H]
SPLASH splash10-01tc-2490000000-52d39d89210406dfbb58
Source of Spectrum J-46-1917-0
Wiley ID 1322031