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3-Acetoxy-6-[(3'-methylbutanoyl)oxy]-Cladiell-11(17)-en-7-ol
SpectraBase Compound ID JKtkzf9dk2S
InChI InChI=1S/C27H44O6/c1-15(2)13-22(29)32-21-11-12-27(8,33-18(6)28)25-24-19(16(3)4)10-9-17(5)23(24)20(31-25)14-26(21,7)30/h15-16,19-21,23-25,30H,5,9-14H2,1-4,6-8H3/t19-,20-,21+,23?,24?,25-,26+,27-/m1/s1
InChIKey IZNFBGOWIHKKIZ-MMYZEDFZSA-N
Mol Weight 464.6 g/mol
Molecular Formula C27H44O6
Exact Mass 464.313789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8YYIT9l3dE
Name 3-Acetoxy-6-[(3'-methylbutanoyl)oxy]-Cladiell-11(17)-en-7-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O6
InChI InChI=1S/C27H44O6/c1-15(2)13-22(29)32-21-11-12-27(8,33-18(6)28)25-24-19(16(3)4)10-9-17(5)23(24)20(31-25)14-26(21,7)30/h15-16,19-21,23-25,30H,5,9-14H2,1-4,6-8H3/t19-,20-,21+,23?,24?,25-,26+,27-/m1/s1
InChIKey IZNFBGOWIHKKIZ-MMYZEDFZSA-N
Molecular Weight 464.643 g/mol
SMILES O[C@]1(C[C@]2(O[C@](C3C2C(=C)CC[C@@]3(C(C)C)[H])([C@](OC(=O)C)(CC[C@@]1(OC(=O)CC(C)C)[H])C)[H])[H])C
SPLASH splash10-015i-9046100000-d5e64ceedd6669b9d68a
Source of Spectrum X2-57-578-2
Wiley ID 1605420