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2beta-Acetoxy-3beta-(angeloyloxy)furanoeremophilane
SpectraBase Compound ID AuFHMAUECD6
InChI InChI=1S/C22H30O5/c1-7-12(2)21(24)27-20-14(4)22(6)10-17-13(3)11-25-18(17)8-16(22)9-19(20)26-15(5)23/h7,11,14,16,19-20H,8-10H2,1-6H3/b12-7-/t14-,16-,19-,20+,22+/m0/s1
InChIKey XYKLXGAMSCMNFT-MIGCLJMXSA-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 B3Fpys6m7oe
Name 2beta-Acetoxy-3beta-(angeloyloxy)furanoeremophilane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-7-12(2)21(24)27-20-14(4)22(6)10-17-13(3)11-25-18(17)8-16(22)9-19(20)26-15(5)23/h7,11,14,16,19-20H,8-10H2,1-6H3/b12-7-/t14-,16-,19-,20+,22+/m0/s1
InChIKey XYKLXGAMSCMNFT-MIGCLJMXSA-N
Literature Reference DOI 10.1002/cber.19741071225
Molecular Weight 374.477 g/mol
SMILES [C@@]1([C@](OC(=O)\C(=C/C)C)([C@](C)([C@@]2(C)Cc3c(C)coc3C[C@@]2([H])C1)[H])[H])(OC(C)=O)[H]
SPLASH splash10-0a59-6901000000-0fc3dc2d77b78b2a4976
Source of Spectrum K-107-3943-31
Synonyms (4aS,5R,6R,7S,8aR)-7-acetoxy-3,4a,5-trimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan-6-yl (Z)-2-methylbut-2-enoate
Wiley ID 1793604