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BULLATACINONE

View entire compound with spectra: 1 NMR

BULLATACINONE
SpectraBase Compound ID 38OK7mNeE9x
InChI InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30-27-29(26-28(2)38)37(41)42-30/h29-36,39-40H,3-27H2,1-2H3/t29?,30-,31+,32-,33+,34+,35+,36+/m1/s1
InChIKey KGGVWMAPBXIMEM-KGKQYZQGSA-N
Mol Weight 622.9 g/mol
Molecular Formula C37H66O7
Exact Mass 622.480854 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7R6vPVKRVKc
Name BULLATACINONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H66O7
InChI InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30-27-29(26-28(2)38)37(41)42-30/h29-36,39-40H,3-27H2,1-2H3/t29?,30-,31+,32-,33+,34+,35+,36+/m1/s1
InChIKey KGGVWMAPBXIMEM-KGKQYZQGSA-N
Literature Reference Author Y.H.HUI,J.K.RUPPRECHT,Y.M.LIU,J.E.ANDERSON,D.L.SMITH,C.J.CHA NG,J.L.MCLAUGHLIN
Literature Reference Citation J.NAT.PROD.,52,463(1989)
Literature Reference DOI 10.1021/np50063a002
Molecular Weight 622.927 g/mol
Solvent CDCl3
Source File Reference UWTS1202