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DCEMMTFCSKSLJN-QFDRSQJZSA-N
SpectraBase Compound ID 3PNqYoRUvfb
InChI InChI=1S/C23H33N3O6/c1-12(8-20-24-10-19(31-20)16-5-6-26(4)25-16)7-17-22(29)21(28)15(11-30-17)9-18-23(32-18)13(2)14(3)27/h5-6,8,10,13-15,17-18,21-23,27-29H,7,9,11H2,1-4H3/b12-8+/t13-,14+,15-,17-,18+,21+,22-,23-/m1/s1
InChIKey DCEMMTFCSKSLJN-QFDRSQJZSA-N
Mol Weight 447.5 g/mol
Molecular Formula C23H33N3O6
Exact Mass 447.236936 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJ1J1GJqaAr
Name DCEMMTFCSKSLJN-QFDRSQJZSA-N
Compound Number 3H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H33N3O6
InChI InChI=1S/C23H33N3O6/c1-12(8-20-24-10-19(31-20)16-5-6-26(4)25-16)7-17-22(29)21(28)15(11-30-17)9-18-23(32-18)13(2)14(3)27/h5-6,8,10,13-15,17-18,21-23,27-29H,7,9,11H2,1-4H3/b12-8+/t13-,14+,15-,17-,18+,21+,22-,23-/m1/s1
InChIKey DCEMMTFCSKSLJN-QFDRSQJZSA-N
Literature Reference Author N.J.P.BROOM,J.S.ELDER,P.C.T.HANNAN,J.E.PONS,P.J.O'HANLON,G.W ALKER,J.WILSON,P.WOO
Literature Reference Citation J.ANTIBIOTICS,48,1336(1995)
Literature Reference DOI 10.7164/antibiotics.48.1336
Molecular Weight 447.532 g/mol
Solvent CD3OD
Source File Reference UWCS24620