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4.alpha.-Acetyl-2.beta.-angeloyl-5.alpha.,10-diisobutyryl-1.beta.,3.alpha.,8,11-tetrahydroxy-Bisabolene
SpectraBase Compound ID 6oO6uhzgiFM
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-/m1/s1
InChIKey BUDAGGCDYODQJC-DPYJPTIFSA-N
Mol Weight 600.7 g/mol
Molecular Formula C30H48O12
Exact Mass 600.314577 g/mol
Enantiomer InChIKey BUDAGGCDYODQJC-XBGUPZODSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Four New Sesquiterpene Polyol Esters from Cremanthodium ellisii Journal of Natural Products 1996

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