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LACHNONE_D
SpectraBase Compound ID 9SHuguGPA2Z
InChI InChI=1S/C15H16O7/c1-15(10-2-3-11(18)21-10)14(20)13(19)12-8(17)4-7(6-16)5-9(12)22-15/h4-5,10,14,16-17,20H,2-3,6H2,1H3/t10-,14+,15-/m0/s1
InChIKey PAPGAOZQPFDLRG-VQISRLSMSA-N
Mol Weight 308.29 g/mol
Molecular Formula C15H16O7
Exact Mass 308.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H42kklyw4Yv
Name Lachnone D
Alternate Name(s) (2R,3S)-3,5-dihydroxy-7-(hydroxymethyl)-2-methyl-2-[(2S)-5-oxo-2-oxolanyl]-3,4-dihydro-2H-1-benzopyran-4-one (2R,3S)-3,5-dihydroxy-7-(hydroxymethyl)-2-methyl-2-[(2S)-5-oxooxolan-2-yl]-3H-chromen-4-one (2R,3S)-3,5-dihydroxy-7-(hydroxymethyl)-2-methyl-2-[(2S)-5-oxotetrahydrofuran-2-yl]chroman-4-one (2R,3S)-7-(hydroxymethyl)-2-methyl-3,5-bis(oxidanyl)-2-[(2S)-5-oxidanylideneoxolan-2-yl]-3H-chromen-4-one
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Formula C15H16O7
InChI InChI=1S/C15H16O7/c1-15(10-2-3-11(18)21-10)14(20)13(19)12-8(17)4-7(6-16)5-9(12)22-15/h4-5,10,14,16-17,20H,2-3,6H2,1H3/t10-,14+,15-/m0/s1
InChIKey PAPGAOZQPFDLRG-VQISRLSMSA-N
Molecular Weight 308.286 g/mol
SMILES OCc1cc(c2C([C@]([C@@](Oc2c1)([C@]1(OC(=O)CC1)[H])C)(O)[H])=O)O
SPLASH splash10-00m0-9550000000-5e1743e7255149b461a8
Source of Spectrum G4-69-981-4
Wiley ID 1694357