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(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

View entire compound with spectra: 1 MS (GC)

(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
SpectraBase Compound ID 7eYMQRECB51
InChI InChI=1S/C26H38O9/c1-10-13(3)23(30)33-16(12-17(27)25(6,7)32-9)15(5)18-19(28)21(29)26(8)22(35-26)20(18)34-24(31)14(4)11-2/h10-11,16-20,22,27-28H,5,12H2,1-4,6-9H3/b13-10-,14-11-/t16-,17-,18-,19-,20+,22-,26+/m1/s1
InChIKey DHYQZUBULNBFRY-APRVYDDCSA-N
Mol Weight 494.6 g/mol
Molecular Formula C26H38O9
Exact Mass 494.251583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mxkrTF8Wf
Name (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
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O9
InChI InChI=1S/C26H38O9/c1-10-13(3)23(30)33-16(12-17(27)25(6,7)32-9)15(5)18-19(28)21(29)26(8)22(35-26)20(18)34-24(31)14(4)11-2/h10-11,16-20,22,27-28H,5,12H2,1-4,6-9H3/b13-10-,14-11-/t16-,17-,18-,19-,20+,22-,26+/m1/s1
InChIKey DHYQZUBULNBFRY-APRVYDDCSA-N
Molecular Weight 494.581 g/mol
SMILES O[C@](C[C@](C([C@]1([C@@]([C@@]2([C@](C([C@@]1(O)[H])=O)(O2)C)[H])(OC(\C(=C/C)C)=O)[H])[H])=C)(OC(\C(=C/C)C)=O)[H])(C(OC)(C)C)[H]
SPLASH splash10-00e9-9002000000-145dac6e79f9ac88d3c9
Source of Spectrum H-90-1037-5
Wiley ID 1590764