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Oxireno[13,14]cyclotetradeca[1,2-b]furan-13(1aH)-one, 11-(acetyloxy)-2,3,6,7,10,11,11a,12,14a,14b-decahydro-1a,5,9-trimethy l-12-methylene-, [1aR-(1aR*,4E,8E,11S*,11aR*,14aS*,14bR*)]-
SpectraBase Compound ID BLTE3LZVbOn
InChI InChI=1S/C22H30O5/c1-13-8-6-9-14(2)12-17(25-16(4)23)18-15(3)21(24)26-19(18)20-22(5,27-20)11-7-10-13/h9-10,17-20H,3,6-8,11-12H2,1-2,4-5H3/b13-10+,14-9+/t17-,18+,19-,20+,22+/m0/s1
InChIKey PTHKHRXTRBUUGO-JMHCWUSJSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BuRKWveVHV
Name Oxireno[13,14]cyclotetradeca[1,2-b]furan-13(1aH)-one, 11-(acetyloxy)-2,3,6,7,10,11,11a,12,14a,14b-decahydro-1a,5,9-trimethy l-12-methylene-, [1aR-(1aR*,4E,8E,11S*,11aR*,14aS*,14bR*)]-
CAS Registry Number 90523-37-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-13-8-6-9-14(2)12-17(25-16(4)23)18-15(3)21(24)26-19(18)20-22(5,27-20)11-7-10-13/h9-10,17-20H,3,6-8,11-12H2,1-2,4-5H3/b13-10+,14-9+/t17-,18+,19-,20+,22+/m0/s1
InChIKey PTHKHRXTRBUUGO-JMHCWUSJSA-N
Molecular Weight 374.477 g/mol
SMILES [C@]12(O[C@@]2(CC\C=C\(CC\C=C\(C[C@@]([C@@]2([C@@]1(OC(=O)C2=C)[H])[H])(OC(=O)C)[H])C)C)C)[H]
SPLASH splash10-03di-0049000000-18a5ad2f545fdf1e10e3
Source of Spectrum B-37-548-0
Synonyms (1aR,11S,11aR,14aS,14bR)-1a,5,9-trimethyl-12-methylene-13-oxo-1a,2,3,6,7,10,11,11a,12,13,14a,14b-dodecahydrooxireno[2',3':13,14]cyclotetradeca[1,2-b]furan-11-yl acetate (7E,11E,1R,2S,3R,4R,14S)-14-acetoxy-3,4-epoxycembra-7,11,15-trien-17,2-olide
Wiley ID 1356751