4.alpha.-Acetyl-2.beta.-angeloyl-5.alpha.,10-diisobutyryl-1.beta.,3.alpha.,8,11-tetrahydroxy-Bisabolene
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 5M5Pfyl7T6m |
|---|---|
| InChI | InChI=1S/C30H48O12/c1-12-16(6)28(36)42-24-22(33)21(17(7)19(32)13-20(29(9,10)37)40-26(34)14(2)3)23(41-27(35)15(4)5)25(30(24,11)38)39-18(8)31/h12,14-15,19-25,32-33,37-38H,7,13H2,1-6,8-11H3/b16-12-/t19?,20?,21-,22-,23-,24-,25-,30+/m0/s1 |
| InChIKey | BUDAGGCDYODQJC-AHBCXUIRSA-N |
| Mol Weight | 600.7 g/mol |
| Molecular Formula | C30H48O12 |
| Exact Mass | 600.314577 g/mol |
| Enantiomer InChIKey | BUDAGGCDYODQJC-ADPGLHRTSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
2-BETA-ANGELOYL-5-ALPHA,8-DIISOBUTYRYL-1-BETA,3-ALPHA,4-ALPHA,9,10,11-HEXAHYDROXYBISABOLENE
3-BETA,4-BETA-EPOXY-1-BETA,2-BETA,8-TRIANGELOYLOXY-BISABOL-7-(14)-ENE
2.beta.-Acetoxy-4.alpha.-chloro-1.beta.,8-bis[(angeloyl)oxy]-3.beta.-hydroxy-10,11-(2',2'-dimethyl)methylenedioxy]-bisabol-7(14)-ene
4.beta.,8.alpha.-Dihydroxy-5.beta.-(2-methylbutyryloxy)-9.beta.-(3-methylbutyryloxy)-3-oxo-germacran-7.beta.,12.alpha.-olide
2.beta.,10-Diacetoxy-4.alpha.-chloro-1.beta.,8-bis[(angeloyl)oxy]-3.beta.-hydroxy-11-methoxybisabol-7(14)-ene
4-ALPHA-CHLORO-2-BETA,10-DIACETOXY-1-BETA,8-DIANGELOYLOXY-11-METHOXY-3-BETA-HYDROXY-BISABOL-7(14)-ENE
NEUROLENIN-H
1-BETA,5-ALPHA,8-TRISANGELOYLOXY-3-BETA,4-BETA,10,11-BISEPOXYBISABOL-7-(14)-ENE-2-BETA-OL
(1.alpha.,2.beta.,3.beta.,5.alpha.,6.beta.)-1,8-bis(Angeloyloxy)-2,3-epoxy-5,10-dihydroxy-11-methoxybisabol-7(14)-en-4-one
1-METHOXY-4,5-DIHYDRONIVEUSIN A
| Title | Journal or Book | Year |
|---|---|---|
| Nor-lignan and sesquiterpenes from Cremanthodium ellisii | Phytochemistry | 2000 |
This compound is available in the following databases:
KnowItAll Mass Spectral Library
Author: Wiley
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Wiley Registry of Mass Spectral Data 2023
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.