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(1.alpha.,2.alpha.,3.beta.,5.alpha.,6.beta.)-1,5,8-tris(Angeloyloxy)-10,11-epoxy-2,3-dihydroxybisabol-7(14)-en-4-one
SpectraBase Compound ID 2WSJzanOJzg
InChI InChI=1S/C30H42O10/c1-11-15(4)26(33)37-19(14-20-29(8,9)40-20)18(7)21-22(38-27(34)16(5)12-2)24(31)30(10,36)25(32)23(21)39-28(35)17(6)13-3/h11-13,19-24,31,36H,7,14H2,1-6,8-10H3/b15-11-,16-12-,17-13-/t19-,20-,21+,22+,23-,24+,30-/m1/s1
InChIKey ZUJSJEBYSRBNKJ-BQKMLIHESA-N
Mol Weight 562.7 g/mol
Molecular Formula C30H42O10
Exact Mass 562.277798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hpsx3HoAbY
Name (1.alpha.,2.alpha.,3.beta.,5.alpha.,6.beta.)-1,5,8-tris(Angeloyloxy)-10,11-epoxy-2,3-dihydroxybisabol-7(14)-en-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42O10
InChI InChI=1S/C30H42O10/c1-11-15(4)26(33)37-19(14-20-29(8,9)40-20)18(7)21-22(38-27(34)16(5)12-2)24(31)30(10,36)25(32)23(21)39-28(35)17(6)13-3/h11-13,19-24,31,36H,7,14H2,1-6,8-10H3/b15-11-,16-12-,17-13-/t19-,20-,21+,22+,23-,24+,30-/m1/s1
InChIKey ZUJSJEBYSRBNKJ-BQKMLIHESA-N
Molecular Weight 562.656 g/mol
SMILES O[C@@]1([C@](C([C@@]([C@]([C@@]1(OC(\C(=C/C)C)=O)[H])(C([C@@](C[C@]1(OC1(C)C)[H])(OC(\C(=C/C)C)=O)[H])=C)[H])(OC(\C(=C/C)C)=O)[H])=O)(O)C)[H]
SPLASH splash10-001i-9010000000-70342039f65f08bce771
Source of Spectrum H-90-1037-3
Wiley ID 1590766