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2-[2-[(3E)-4,8-dimethylnona-3,7-dienyl]-3,5-dihydroxy-7-keto-2-methyl-4,9-dihydro-3H-pyrano[5,6-g]isoindol-8-yl]-3-hydroxy-propionic acid

View entire compound with spectra: 1 NMR

2-[2-[(3E)-4,8-dimethylnona-3,7-dienyl]-3,5-dihydroxy-7-keto-2-methyl-4,9-dihydro-3H-pyrano[5,6-g]isoindol-8-yl]-3-hydroxy-propionic acid
SpectraBase Compound ID C0wbPd1Equn
InChI InChI=1S/C26H35NO7/c1-15(2)7-5-8-16(3)9-6-10-26(4)22(30)12-18-21(29)11-17-19(23(18)34-26)13-27(24(17)31)20(14-28)25(32)33/h7,9,11,20,22,28-30H,5-6,8,10,12-14H2,1-4H3,(H,32,33)/b16-9+
InChIKey BWPFIDWJPVFHKS-CXUHLZMHSA-N
Mol Weight 473.6 g/mol
Molecular Formula C26H35NO7
Exact Mass 473.241352 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KsPLw5MUWSr
Name 2-[2-[(3E)-4,8-dimethylnona-3,7-dienyl]-3,5-dihydroxy-7-keto-2-methyl-4,9-dihydro-3H-pyrano[5,6-g]isoindol-8-yl]-3-hydroxy-propionic acid
Compound Number SMTP-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H35NO7
InChI InChI=1S/C26H35NO7/c1-15(2)7-5-8-16(3)9-6-10-26(4)22(30)12-18-21(29)11-17-19(23(18)34-26)13-27(24(17)31)20(14-28)25(32)33/h7,9,11,20,22,28-30H,5-6,8,10,12-14H2,1-4H3,(H,32,33)/b16-9+
InChIKey BWPFIDWJPVFHKS-CXUHLZMHSA-N
Literature Reference Author K.HASUMI,S.OHYAMA,T.KOHYAMA,Y.OHSAKI,R.TAKAYASU,A.ENDO
Literature Reference Citation J.ANTIBIOTICS,51,1059(1998)
Literature Reference DOI 10.7164/antibiotics.51.1059
Molecular Weight 473.566 g/mol
Solvent DMSO-D6
Source File Reference UWKP1901