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Sinugibberoside A [(1S*,4S*,5S*,9R*,11S*,12R*,15R*)-4,5-epoxy-12,15-epidioxy-17-acetoxy-xeniaphylla-8(19),13,dien-12-ol]
SpectraBase Compound ID KzXkbB9Mv1o
InChI InChI=1S/C22H32O6/c1-14-6-7-18-21(5,26-18)9-8-17-16(14)12-20(17,4)22(24)11-10-19(3,27-28-22)13-25-15(2)23/h10-11,16-18,24H,1,6-9,12-13H2,2-5H3/t16-,17-,18-,19+,20-,21-,22+/m0/s1
InChIKey UMAFMVJKBJNJKP-XZNYGTFNSA-N
Mol Weight 392.5 g/mol
Molecular Formula C22H32O6
Exact Mass 392.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkJ4cKfcVbL
Name Sinugibberoside A [(1S*,4S*,5S*,9R*,11S*,12R*,15R*)-4,5-epoxy-12,15-epidioxy-17-acetoxy-xeniaphylla-8(19),13,dien-12-ol]
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Formula C22H32O6
InChI InChI=1S/C22H32O6/c1-14-6-7-18-21(5,26-18)9-8-17-16(14)12-20(17,4)22(24)11-10-19(3,27-28-22)13-25-15(2)23/h10-11,16-18,24H,1,6-9,12-13H2,2-5H3/t16-,17-,18-,19+,20-,21-,22+/m0/s1
InChIKey UMAFMVJKBJNJKP-XZNYGTFNSA-N
Molecular Weight 392.492 g/mol
SMILES O[C@@]1([C@@]2([C@]3(CC[C@@]4(O[C@@]4([H])CCC([C@@]3(C2)[H])=C)C)[H])C)OO[C@](C=C1)(COC(=O)C)C
SPLASH splash10-002e-9600000000-23bae4c8bb2cc7f53e59
Source of Spectrum F-62-6806-1
Wiley ID 1639796