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JBIR-02;MAJOR-TAUTOMER
SpectraBase Compound ID 1K5YFsSR11n
InChI InChI=1S/C27H39NO3/c1-9-18(2)15-21(5)27(30)22(6)16-20(4)12-10-11-19(3)13-14-24-23(7)25(29)17-26(28-24)31-8/h9-10,12-13,15-17,22,27,30H,11,14H2,1-8H3,(H,28,29)/b12-10+,18-9+,19-13+,20-16+,21-15+
InChIKey AIDLWDQRTGLLNU-RLAGNCKMSA-N
Mol Weight 425.6 g/mol
Molecular Formula C27H39NO3
Exact Mass 425.292994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9TaQrQF8T6m
Name JBIR-02;MINOR-TAUTOMER
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H39NO3
InChI InChI=1S/C27H39NO3/c1-9-18(2)15-21(5)27(30)22(6)16-20(4)12-10-11-19(3)13-14-24-23(7)25(29)17-26(28-24)31-8/h9-10,12-13,15-17,22,27,30H,11,14H2,1-8H3,(H,28,29)/b12-10+,18-9+,19-13+,20-16+,21-15+
InChIKey AIDLWDQRTGLLNU-RLAGNCKMSA-N
Literature Reference Author J.Y.UEDA,T.TOGASHI,S.MATUKURA,A.NAGAI,T.NAKASHIMA,H.KOMAKI,K .ANZAI,S.HARAYAMA.T.
Literature Reference Citation J.ANTIBIOTICS,60,459(2007)
Literature Reference DOI 10.1038/ja.2007.59
Molecular Weight 425.612 g/mol
Solvent CDCl3
Source File Reference UWDB113