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Kauran-3-one, 17,18-bis(acetyloxy)-16-hydroxy-, (4.beta.,5.alpha.,9.alpha.,10.beta.)-
SpectraBase Compound ID IEG7I5nPcEg
InChI InChI=1S/C24H36O6/c1-15(25)29-13-22(4)18-7-10-23-11-17(24(28,12-23)14-30-16(2)26)5-6-19(23)21(18,3)9-8-20(22)27/h17-19,28H,5-14H2,1-4H3/t17-,18+,19+,21-,22+,23+,24-/m0/s1
InChIKey YXNJBOPJNBXMGA-XUOWHRJCSA-N
Mol Weight 420.5 g/mol
Molecular Formula C24H36O6
Exact Mass 420.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LgVFd1zpzQL
Name Kauran-3-one, 17,18-bis(acetyloxy)-16-hydroxy-, (4.beta.,5.alpha.,9.alpha.,10.beta.)-
CAS Registry Number 84744-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O6
InChI InChI=1S/C24H36O6/c1-15(25)29-13-22(4)18-7-10-23-11-17(24(28,12-23)14-30-16(2)26)5-6-19(23)21(18,3)9-8-20(22)27/h17-19,28H,5-14H2,1-4H3/t17-,18+,19+,21-,22+,23+,24-/m0/s1
InChIKey YXNJBOPJNBXMGA-XUOWHRJCSA-N
Molecular Weight 420.546 g/mol
SMILES O[C@@]1(C[C@@]23[C@@]([C@@]4([C@]([C@](COC(=O)C)(C)C(CC4)=O)(CC2)[H])C)(CC[C@]1(C3)[H])[H])COC(=O)C
SPLASH splash10-0007-9014000000-e0631abcb8ea42646c2b
Source of Spectrum H-65-2196-0
Synonyms (16R)-17,19-diacetoxy-16-hydroxyphyllocladan-3-one (4alpha,16beta)-17-(acetyloxy)-16-hydroxy-3-oxokauran-18-yl acetate 7H-2,10a-ethanophenanthrene, kauran-3-one deriv.
Wiley ID 1378005