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PALLIDONE-I
SpectraBase Compound ID 5fn6Rj6pzfb
InChI InChI=1S/C25H32O5/c1-15(2)12-18(26)13-16(3)8-7-11-25(5)17(4)22-23(27)20-10-9-19(28-6)14-21(20)29-24(22)30-25/h8-10,14-15,17H,7,11-13H2,1-6H3/b16-8+/t17-,25-/m1/s1
InChIKey WODHGNNMBPUNHS-GEQKCUNQSA-N
Mol Weight 412.5 g/mol
Molecular Formula C25H32O5
Exact Mass 412.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbfzttNBGL9
Name (2R,3R)-2-[(E)-4,8-dimethyl-6-oxidanylidene-non-3-enyl]-7-methoxy-2,3-dimethyl-3H-furo[2,3-b]chromen-4-one
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Formula C25H32O5
InChI InChI=1S/C25H32O5/c1-15(2)12-18(26)13-16(3)8-7-11-25(5)17(4)22-23(27)20-10-9-19(28-6)14-21(20)29-24(22)30-25/h8-10,14-15,17H,7,11-13H2,1-6H3/b16-8+/t17-,25-/m1/s1
InChIKey WODHGNNMBPUNHS-GEQKCUNQSA-N
Molecular Weight 412.526 g/mol
SMILES C12=C(Oc3c(C2=O)ccc(OC)c3)O[C@@]([C@@]1(C)[H])(CC\C=C\(CC(=O)CC(C)C)C)C
SPLASH splash10-0pvv-5592100000-c66c95d0be26436e5416
Source of Spectrum G4-63-522-3
Synonyms (2R,3R)-2-[(E)-4,8-dimethyl-6-oxo-non-3-enyl]-7-methoxy-2,3-dimethyl-3H-furo[2,3-b]chromen-4-one (2R,3R)-2-[(E)-4,8-dimethyl-6-oxonon-3-enyl]-7-methoxy-2,3-dimethyl-3H-furo[2,3-b][1]benzopyran-4-one (2R,3R)-2-[(E)-6-keto-4,8-dimethyl-non-3-enyl]-7-methoxy-2,3-dimethyl-3H-furo[2,3-b]chromen-4-one
Wiley ID 1608351