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8.alpha.-Acetyl-1.beta.-H,5.beta.-H,7.alpha.-H-15-(angeloyloxy)-6.beta.-hydroxygermacrane
SpectraBase Compound ID 6nNPbJIY7jV
InChI InChI=1S/C22H34O5/c1-7-16(5)22(25)26-13-18-10-8-9-15(4)11-20(27-17(6)23)21(14(2)3)19(24)12-18/h7,9,12,14,19-21,24H,8,10-11,13H2,1-6H3/b15-9+,16-7+,18-12-/t19-,20-,21-/m0/s1
InChIKey VGTTVAAIDFWDEA-BBRWMWLPSA-N
Mol Weight 378.5 g/mol
Molecular Formula C22H34O5
Exact Mass 378.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MolyPdGJuN
Name 8.alpha.-Acetyl-1.beta.-H,5.beta.-H,7.alpha.-H-15-(angeloyloxy)-6.beta.-hydroxygermacrane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O5
InChI InChI=1S/C22H34O5/c1-7-16(5)22(25)26-13-18-10-8-9-15(4)11-20(27-17(6)23)21(14(2)3)19(24)12-18/h7,9,12,14,19-21,24H,8,10-11,13H2,1-6H3/b15-9+,16-7+,18-12-/t19-,20-,21-/m0/s1
InChIKey VGTTVAAIDFWDEA-BBRWMWLPSA-N
Molecular Weight 378.509 g/mol
SMILES O[C@@]1([C@@]([C@@](OC(=O)C)(C\C(=C\CC\C(=C\1)COC(\C(=C\C)C)=O)C)[H])(C(C)C)[H])[H]
SPLASH splash10-001l-9020000000-1efea2d5c3d85df1a53e
Source of Spectrum G4-69-1570-10
Wiley ID 1694522