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2-BETA,8-BISANGELOYLOXY-4-ALPHA-CHLORO-10,11-EPOXYBISABOL-7-(14)-ENE-1-BETA,3-BETA-DIOL
SpectraBase Compound ID A7dGnG13qjm
InChI InChI=1S/C25H37ClO7/c1-9-13(3)22(28)31-17(12-19-24(6,7)33-19)15(5)16-11-18(26)25(8,30)21(20(16)27)32-23(29)14(4)10-2/h9-10,16-21,27,30H,5,11-12H2,1-4,6-8H3/b13-9-,14-10-/t16-,17?,18+,19?,20+,21+,25-/m1/s1
InChIKey DGJSOBCOIVBILD-VVWVYMMPSA-N
Mol Weight 485.0 g/mol
Molecular Formula C25H37ClO7
Exact Mass 484.222781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5hzkc85pTE8
Name 2-BETA,8-BISANGELOYLOXY-4-ALPHA-CHLORO-10,11-EPOXYBISABOL-7-(14)-ENE-1-BETA,3-BETA-DIOL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H37ClO7
InChI InChI=1S/C25H37ClO7/c1-9-13(3)22(28)31-17(12-19-24(6,7)33-19)15(5)16-11-18(26)25(8,30)21(20(16)27)32-23(29)14(4)10-2/h9-10,16-21,27,30H,5,11-12H2,1-4,6-8H3/b13-9-,14-10-/t16-,17?,18+,19?,20+,21+,25-/m1/s1
InChIKey DGJSOBCOIVBILD-VVWVYMMPSA-N
Literature Reference Author H.ONUKI,M.YAMAZAKI,A.NAKAMURA,R.HANAI,C.KURODA,X.GONG,Y.SHEN ,H.HIROTA
Literature Reference Citation J.NAT.PROD.,71,520(2008)
Literature Reference DOI 10.1021/np070195p
Molecular Weight 485.018 g/mol
Sample ID 27546
Solvent C6D6