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3.alpha.,11.beta.,16.alpha.-Triacetoxy-15-oxo-(16S)-Kaurane
SpectraBase Compound ID DZYGjEY0rJg
InChI InChI=1S/C26H38O7/c1-14(27)31-18-12-17-13-26(22(30)25(17,7)33-16(3)29)11-8-19-23(4,5)20(32-15(2)28)9-10-24(19,6)21(18)26/h17-21H,8-13H2,1-7H3/t17?,18-,19?,20+,21-,24+,25-,26+/m0/s1
InChIKey GAYPMKYQLPMSGR-KZVIYITLSA-N
Mol Weight 462.6 g/mol
Molecular Formula C26H38O7
Exact Mass 462.261754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bsekqIy5UL
Name 3.alpha.,11.beta.,16.alpha.-Triacetoxy-15-oxo-(16S)-Kaurane
Alternate Name(s) (3alpha,8alpha,9beta,10alpha,11beta,16beta)-11,16-bis(acetyloxy)-15-oxokauran-3-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O7
InChI InChI=1S/C26H38O7/c1-14(27)31-18-12-17-13-26(22(30)25(17,7)33-16(3)29)11-8-19-23(4,5)20(32-15(2)28)9-10-24(19,6)21(18)26/h17-21H,8-13H2,1-7H3/t17?,18-,19?,20+,21-,24+,25-,26+/m0/s1
InChIKey GAYPMKYQLPMSGR-KZVIYITLSA-N
Molecular Weight 462.583 g/mol
SMILES [C@]123C([C@](OC(=O)C)(C)C(C3)C[C@@]([C@]2([C@@]2(CC[C@](C(C2CC1)(C)C)(OC(=O)C)[H])C)[H])(OC(=O)C)[H])=O
SPLASH splash10-07fu-0097000000-53eb75136dd87c06a702
Source of Spectrum G4-59-957-29
Wiley ID 1606519