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11,13-Dihydro-3-[(tetrahydropyranyl)oxy]-11.beta.-hydroxyarbusculin B
SpectraBase Compound ID 6yjXY9HMuhR
InChI InChI=1S/C20H30O5/c1-12-14(24-15-6-4-5-11-23-15)8-10-19(2)9-7-13-17(16(12)19)25-18(21)20(13,3)22/h13-15,17,22H,4-11H2,1-3H3/t13?,14?,15?,17-,19-,20+/m0/s1
InChIKey UZENWIOZQYEQES-QXQLVIBGSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vgdvIgFHP6
Name 11,13-Dihydro-3-[(tetrahydropyranyl)oxy]-11.beta.-hydroxyarbusculin B
Alternate Name(s) (3R,3aS)-3-hydroxy-3,5a,9-trimethyl-7-(tetrahydro-2H-pyran-2-yloxy)-3a,4,5,5a,6,7,8,9b-octahydronaphtho[1,2-b]furan-2(3H)-one (3R,5aS,9bS)-3-Hydroxy-3,5a,9-trimethyl-8-(tetrahydro-pyran-2-yloxy)-3a,4,5,5a,6,7,8,9b-octahydro-3H-naphtho[1,2-b]furan-2-one
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Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-12-14(24-15-6-4-5-11-23-15)8-10-19(2)9-7-13-17(16(12)19)25-18(21)20(13,3)22/h13-15,17,22H,4-11H2,1-3H3/t13?,14?,15?,17-,19-,20+/m0/s1
InChIKey UZENWIOZQYEQES-QXQLVIBGSA-N
Molecular Weight 350.455 g/mol
SMILES O[C@@]1(C2[C@@](C3=C(C(OC4OCCCC4)CC[C@]3(C)CC2)C)(OC1=O)[H])C
SPLASH splash10-000i-9050000000-7070d53d46aac22f6462
Source of Spectrum F-50-5448-16
Wiley ID 1342023