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2,4-Dihydroxyparthenin

View entire compound with spectra: 1 MS (GC)

2,4-Dihydroxyparthenin
SpectraBase Compound ID x3ztGBSHVh
InChI InChI=1S/C15H22O5/c1-7-4-5-9-8(2)13(18)20-12(9)14(3)10(16)6-11(17)15(7,14)19/h7,9-12,16-17,19H,2,4-6H2,1,3H3/t7-,9?,10-,11-,12+,14-,15-/m0/s1
InChIKey KGOLCZJNYSVUEZ-RHQNNQCNSA-N
Mol Weight 282.34 g/mol
Molecular Formula C15H22O5
Exact Mass 282.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52AabRlHm29
Name 2,4-Dihydroxyparthenin
Alternate Name(s) (6S,6aR,7S,9S,9aS,9bR)-6a,7,9-Trihydroxy-6,9a-dimethyl-3-methylene-decahydro-azuleno[4,5-b]furan-2-one (6S,6aR,7S,9S,9aS,9bR)-6a,7,9-trihydroxy-6,9a-dimethyl-3-methylenedecahydroazuleno[4,5-b]furan-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O5
InChI InChI=1S/C15H22O5/c1-7-4-5-9-8(2)13(18)20-12(9)14(3)10(16)6-11(17)15(7,14)19/h7,9-12,16-17,19H,2,4-6H2,1,3H3/t7-,9?,10-,11-,12+,14-,15-/m0/s1
InChIKey KGOLCZJNYSVUEZ-RHQNNQCNSA-N
Molecular Weight 282.336 g/mol
SMILES O[C@]1(C[C@@]([C@@]2([C@@]1([C@](CCC1C(C(O[C@@]21[H])=O)=C)(C)[H])O)C)(O)[H])[H]
SPLASH splash10-0udi-0090000000-7402f80270240da198e5
Source of Spectrum F-55-6590-4
Wiley ID 838033