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ERYTHRO-23-O-METHYLNEOCYCLOCITRINOL;EPIMER_1
SpectraBase Compound ID 8lwPqBBedI1
InChI InChI=1S/C26H38O4/c1-15(11-25(30-4)16(2)27)22-7-8-23-21-14-24(29)18-12-17(5-6-19(28)13-18)20(21)9-10-26(22,23)3/h5,11,14,16,18-20,22-23,25,27-28H,6-10,12-13H2,1-4H3/b15-11+/t16-,18-,19-,20+,22?,23-,25+,26+/m0/s1
InChIKey KJZPRGNCDGAUNA-CRIDJSPLSA-N
Mol Weight 414.6 g/mol
Molecular Formula C26H38O4
Exact Mass 414.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AGItFEvdSi2
Name ERYTHRO-23-O-METHYLNEOCYCLOCITRINOL;EPIMER_1
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H38O4
InChI InChI=1S/C26H38O4/c1-15(11-25(30-4)16(2)27)22-7-8-23-21-14-24(29)18-12-17(5-6-19(28)13-18)20(21)9-10-26(22,23)3/h5,11,14,16,18-20,22-23,25,27-28H,6-10,12-13H2,1-4H3/b15-11+/t16-,18-,19-,20+,22?,23-,25+,26+/m0/s1
InChIKey KJZPRGNCDGAUNA-CRIDJSPLSA-N
Literature Reference Author L.DU,T.ZHU,Y.FANG,Q.GU,W.ZHU
Literature Reference Citation J.NAT.PROD.,71,1343(2008)
Literature Reference DOI 10.1021/np8000442
Molecular Weight 414.585 g/mol
Sample ID 28437
Solvent DMSO-D6