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DIHYDROXY-ACIDISSIMINOL;BENZAMIDE-N-[PARA-[(3,7-DIMETHYL-4,6,7-TRIHYDROXY-2-OCTENYL)-OXY]-PHENETHYL]
SpectraBase Compound ID Crrv4vlCsh6
InChI InChI=1S/C25H33NO5/c1-18(22(27)17-23(28)25(2,3)30)14-16-31-21-11-9-19(10-12-21)13-15-26-24(29)20-7-5-4-6-8-20/h4-12,14,22-23,27-28,30H,13,15-17H2,1-3H3,(H,26,29)/b18-14+
InChIKey GDCAKUNBXRNADM-NBVRZTHBSA-N
Mol Weight 427.5 g/mol
Molecular Formula C25H33NO5
Exact Mass 427.235873 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GLG5BKZrM2n
Name DIHYDROXY-ACIDISSIMINOL;BENZAMIDE-N-[PARA-[(3,7-DIMETHYL-4,6,7-TRIHYDROXY-2-OCTENYL)-OXY]-PHENETHYL]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H33NO5
InChI InChI=1S/C25H33NO5/c1-18(22(27)17-23(28)25(2,3)30)14-16-31-21-11-9-19(10-12-21)13-15-26-24(29)20-7-5-4-6-8-20/h4-12,14,22-23,27-28,30H,13,15-17H2,1-3H3,(H,26,29)/b18-14+
InChIKey GDCAKUNBXRNADM-NBVRZTHBSA-N
Literature Reference Author P.GHOSH,M.K.GHOSH,S.THAKUR,J.DAN,T.AKIHISA,T.TAMURA,Y.KIMURA
Literature Reference Citation PHYTOCHEM.,37,757(1994)
Literature Reference DOI 10.1016/S0031-9422(00)90353-4
Molecular Weight 427.541 g/mol
Solvent CDCl3
Source File Reference UWLU23448