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(+-)-trans-Deguelin [(trans)-13,13a-dihydro-9,10-dimethoxy-3,3-dimethyl-3H-bis[1]benzopyrano[3,4-b;6',5'-e]pyran-7(7aH)-one]

View entire compound with spectra: 1 MS (GC)

(+-)-trans-Deguelin [(trans)-13,13a-dihydro-9,10-dimethoxy-3,3-dimethyl-3H-bis[1]benzopyrano[3,4-b;6',5'-e]pyran-7(7aH)-one]
SpectraBase Compound ID FvHmuuRPOma
InChI InChI=1S/C23H22O6/c1-23(2)8-7-12-15(29-23)6-5-13-21(24)20-14-9-17(25-3)18(26-4)10-16(14)27-11-19(20)28-22(12)13/h5-10,19-20H,11H2,1-4H3/t19-,20-/m1/s1
InChIKey ORDAZKGHSNRHTD-WOJBJXKFSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdZ09GhmVR8
Name (+-)-trans-Deguelin [(trans)-13,13a-dihydro-9,10-dimethoxy-3,3-dimethyl-3H-bis[1]benzopyrano[3,4-b;6',5'-e]pyran-7(7aH)-one]
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Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-23(2)8-7-12-15(29-23)6-5-13-21(24)20-14-9-17(25-3)18(26-4)10-16(14)27-11-19(20)28-22(12)13/h5-10,19-20H,11H2,1-4H3/t19-,20-/m1/s1
InChIKey ORDAZKGHSNRHTD-WOJBJXKFSA-N
Molecular Weight 394.423 g/mol
SMILES c12c(C([C@@]3(c4c(cc(c(c4)OC)OC)OC[C@]3(O1)[H])[H])=O)ccc1c2C=CC(C)(C)O1
SPLASH splash10-0006-0905000000-c86586f7e0270e4e74d6
Source of Spectrum KC-0-2611-14
Wiley ID 779956