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(+-)-Duocarmycin SA
SpectraBase Compound ID J8ceUMelHsZ
InChI InChI=1S/C25H23N3O7/c1-32-17-6-11-5-14(26-19(11)22(34-3)21(17)33-2)23(30)28-10-12-9-25(12)13-7-15(24(31)35-4)27-20(13)16(29)8-18(25)28/h5-8,12,26-27H,9-10H2,1-4H3
InChIKey VQNATVDKACXKTF-UHFFFAOYSA-N
Mol Weight 477.47 g/mol
Molecular Formula C25H23N3O7
Exact Mass 477.1536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 72fe3xNmGmT
Name (+)-DUOCARMYCIN-SA
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H23N3O7
InChI InChI=1S/C25H23N3O7/c1-32-17-6-11-5-14(26-19(11)22(34-3)21(17)33-2)23(30)28-10-12-9-25(12)13-7-15(24(31)35-4)27-20(13)16(29)8-18(25)28/h5-8,12,26-27H,9-10H2,1-4H3
InChIKey VQNATVDKACXKTF-UHFFFAOYSA-N
Literature Reference Author D.L.BOGNER,D.S.JOHNSON,W.YUN
Literature Reference Citation J.AM.CHEM.SOC.,116,1635(1994)
Literature Reference DOI 10.1021/ja00084a004
Molecular Weight 477.474 g/mol
Solvent ACETONE-D6
Source File Reference UWRU7003