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HYDROXYMYCOTRIENIN-B
SpectraBase Compound ID DUb3AVOoM5Q
InChI InChI=1S/C36H48N2O9/c1-22-14-13-18-27-32(42)28(21-30(40)33(27)43)38-31(41)20-26(46-4)17-11-6-5-7-12-19-29(39)23(2)34(22)47-36(45)24(3)37-35(44)25-15-9-8-10-16-25/h5-7,11-12,14,17,21,23-26,29,34,39,43H,8-10,13,15-16,18-20H2,1-4H3,(H,37,44)(H,38,41)/b6-5+,12-7+,17-11+,22-14-
InChIKey VFYQTGKSDWNROF-UWGPBQIPSA-N
Mol Weight 652.8 g/mol
Molecular Formula C36H48N2O9
Exact Mass 652.335981 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gza5pYilJYe
Name HYDROXYMYCOTRIENIN-B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H48N2O9
InChI InChI=1S/C36H48N2O9/c1-22-14-13-18-27-32(42)28(21-30(40)33(27)43)38-31(41)20-26(46-4)17-11-6-5-7-12-19-29(39)23(2)34(22)47-36(45)24(3)37-35(44)25-15-9-8-10-16-25/h5-7,11-12,14,17,21,23-26,29,34,39,43H,8-10,13,15-16,18-20H2,1-4H3,(H,37,44)(H,38,41)/b6-5+,12-7+,17-11+,22-14-
InChIKey VFYQTGKSDWNROF-UWGPBQIPSA-N
Literature Reference Author N.HOSOKAWA,H.NAGANAWA,M.HAMADA,T.TAKEUCHI,S.IKENO,M.HORI
Literature Reference Citation J.ANTIBIOTICS,49,425(1996)
Literature Reference DOI 10.7164/antibiotics.49.425
Molecular Weight 652.785 g/mol
Solvent PYRIDINE-D5
Source File Reference UWGE5159