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((1R*,3R*,5S*,6R*,7S*,9S*)-5-(2',3'-diacetoxy-1',5'-dimethyl-4'-en-1'-yl)-2,8-dimethylenebicyclo[5.3.0]decan-3,6,9-triol
SpectraBase Compound ID 2ig8KX5YWUh
InChI InChI=1S/C24H36O7/c1-11(2)8-21(30-15(6)25)24(31-16(7)26)13(4)18-10-19(27)12(3)17-9-20(28)14(5)22(17)23(18)29/h8,13,17-24,27-29H,3,5,9-10H2,1-2,4,6-7H3/t13?,17-,18-,19+,20-,21?,22+,23+,24?/m0/s1
InChIKey LHCXAGDTURPWGN-SBBKVVNTSA-N
Mol Weight 436.5 g/mol
Molecular Formula C24H36O7
Exact Mass 436.246103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHzD7EFqnNP
Name ((1R*,3R*,5S*,6R*,7S*,9S*)-5-(2',3'-diacetoxy-1',5'-dimethyl-4'-en-1'-yl)-2,8-dimethylenebicyclo[5.3.0]decan-3,6,9-triol
Alternate Name(s) 1-[2-[(2S,3aR,4R,5S,7R,8aR)-4,7-dihydroxy-2-methyl-8-methylene-3-oxodecahydro-5-azulenyl]-1-(acetyloxy)propyl]-3-methyl-2-butenyl acetate Acetic acid [6-[(2S,3aS,4R,5S,7R,8aR)-2,4,7-trihydroxy-3,8-dimethylene-1,2,3a,4,5,6,7,8a-octahydroazulen-5-yl]-5-acetyloxy-2-methylhept-2-en-4-yl] ester [6-[(2S,3aS,4R,5S,7R,8aR)-2,4,7-trihydroxy-3,8-dimethylidene-1,2,3a,4,5,6,7,8a-octahydroazulen-5-yl]-5-acetyloxy-2-methylhept-2-en-4-yl] acetate [1-[2-[(2S,3aS,4R,5S,7R,8aR)-2,4,7-trihydroxy-3,8-dimethylene-1,2,3a,4,5,6,7,8a-octahydroazulen-5-yl]-1-acetoxy-propyl]-3-methyl-but-2-enyl] acetate [6-[(2S,3aS,4R,5S,7R,8aR)-3,8-dimethylidene-2,4,7-tris(oxidanyl)-1,2,3a,4,5,6,7,8a-octahydroazulen-5-yl]-5-acetyloxy-2-methyl-hept-2-en-4-yl] ethanoate
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Formula C24H36O7
InChI InChI=1S/C24H36O7/c1-11(2)8-21(30-15(6)25)24(31-16(7)26)13(4)18-10-19(27)12(3)17-9-20(28)14(5)22(17)23(18)29/h8,13,17-24,27-29H,3,5,9-10H2,1-2,4,6-7H3/t13?,17-,18-,19+,20-,21?,22+,23+,24?/m0/s1
InChIKey LHCXAGDTURPWGN-SBBKVVNTSA-N
Molecular Weight 436.545 g/mol
SMILES O[C@]1(C([C@]2([C@@](C([C@](C2)(O)[H])=C)([C@@]([C@@](C1)(C(C(C(C=C(C)C)OC(=O)C)OC(=O)C)C)[H])(O)[H])[H])[H])=C)[H]
SPLASH splash10-000f-9110000000-5639db0b59e656a58173
Source of Spectrum F-49-578-1
Wiley ID 1383522