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Longeracemosone E

View entire compound with spectra: 1 MS (GC)

Longeracemosone E
SpectraBase Compound ID 6fCHmoSNtGc
InChI InChI=1S/C25H26O6/c1-24(2)11-10-14-18(26)17-19(27)20(28)21(13-8-6-5-7-9-13)29-23(17)15(22(14)31-24)12-16-25(3,4)30-16/h5-11,16,20-21,26,28H,12H2,1-4H3/t16?,20-,21+/m0/s1
InChIKey HBRBYGIRLUJXOH-KCECWRNFSA-N
Mol Weight 422.48 g/mol
Molecular Formula C25H26O6
Exact Mass 422.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TAFT4ofMGm
Name Longeracemosone E
Alternate Name(s) (7R,8R)-10-[(3,3-dimethyl-2-oxiranyl)methyl]-5,7-dihydroxy-2,2-dimethyl-8-phenyl-7,8-dihydropyrano[3,2-g][1]benzopyran-6-one (7R,8R)-10-[(3,3-dimethyloxiran-2-yl)methyl]-2,2-dimethyl-5,7-bis(oxidanyl)-8-phenyl-7,8-dihydropyrano[3,2-g]chromen-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O6
InChI InChI=1S/C25H26O6/c1-24(2)11-10-14-18(26)17-19(27)20(28)21(13-8-6-5-7-9-13)29-23(17)15(22(14)31-24)12-16-25(3,4)30-16/h5-11,16,20-21,26,28H,12H2,1-4H3/t16?,20-,21+/m0/s1
InChIKey HBRBYGIRLUJXOH-KCECWRNFSA-N
Molecular Weight 422.477 g/mol
SMILES Oc1c2C=CC(Oc2c(c2c1C([C@@]([C@](O2)(c1ccccc1)[H])(O)[H])=O)CC1OC1(C)C)(C)C
SPLASH splash10-0a4i-0140900000-9502738b4ca6f9be7e18
Source of Spectrum U1-2011-3808-5
Wiley ID 1665650