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5'-[11-(Furan-3"-yl)-1,4-dihydroxy-4,8-dimethylundeca-4,8-dien-1-yl]-dihydro-5-methylfuran-2(3H)-one
SpectraBase Compound ID 6xnGNUe2Hue
InChI InChI=1S/C22H32O5/c1-17(6-4-8-18-11-15-26-16-18)7-5-12-21(2,25)13-9-19(23)22(3)14-10-20(24)27-22/h5-6,11-12,15-16,19,23,25H,4,7-10,13-14H2,1-3H3/b12-5+,17-6+/t19-,21?,22+/m1/s1
InChIKey LMCVGYPFPPMZGR-BHNNYIFHSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FNhHlMXWCm
Name 5'-[11-(Furan-3"-yl)-1,4-dihydroxy-4,8-dimethylundeca-4,8-dien-1-yl]-dihydro-5-methylfuran-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-17(6-4-8-18-11-15-26-16-18)7-5-12-21(2,25)13-9-19(23)22(3)14-10-20(24)27-22/h5-6,11-12,15-16,19,23,25H,4,7-10,13-14H2,1-3H3/b12-5+,17-6+/t19-,21?,22+/m1/s1
InChIKey LMCVGYPFPPMZGR-BHNNYIFHSA-N
Molecular Weight 376.493 g/mol
SMILES OC(CC[C@]([C@]1(OC(=O)CC1)C)(O)[H])(\C=C\C\C(=C\CCc1cocc1)C)C
SPLASH splash10-0002-9306000000-d4483e7447cf84389305
Source of Spectrum H-92-2109-6
Synonyms Irciformonin J (5S)-5-[(1R,5E,8E)-11-(3-furanyl)-1,4-dihydroxy-4,8-dimethylundeca-5,8-dienyl]-5-methyl-2-oxolanone (5S)-5-[(1R,5E,8E)-11-(furan-3-yl)-1,4-dihydroxy-4,8-dimethylundeca-5,8-dienyl]-5-methyloxolan-2-one (5S)-5-[(1R,5E,8E)-11-(furan-3-yl)-4,8-dimethyl-1,4-bis(oxidanyl)undeca-5,8-dienyl]-5-methyl-oxolan-2-one
Wiley ID 1693745