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C-12,15-CIS-BULLATANOCIN
SpectraBase Compound ID Henja9hSssq
InChI InChI=1S/C37H66O8/c1-3-4-5-6-7-8-12-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-30(44-34)17-14-11-9-10-13-16-29(38)26-28-25-27(2)43-37(28)42/h25,27,29-36,38-41H,3-24,26H2,1-2H3/t27-,29+,30-,31-,32-,33-,34-,35-,36-/m0/s1
InChIKey HKMBLJVHVBJAIH-QPRLZOLLSA-N
Mol Weight 638.9 g/mol
Molecular Formula C37H66O8
Exact Mass 638.475769 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9irgzy9UbzQ
Name C-12,15-CIS-BULLATANOCIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H66O8
InChI InChI=1S/C37H66O8/c1-3-4-5-6-7-8-12-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-30(44-34)17-14-11-9-10-13-16-29(38)26-28-25-27(2)43-37(28)42/h25,27,29-36,38-41H,3-24,26H2,1-2H3/t27-,29+,30-,31-,32-,33-,34-,35-,36-/m0/s1
InChIKey HKMBLJVHVBJAIH-QPRLZOLLSA-N
Literature Reference Author Z.M.GU,L.ZENG,J.L.MCLAUGHLIN
Literature Reference Citation HETEROCYCLES,41,229(1995)
Literature Reference DOI 10.3987/COM-94-6943
Molecular Weight 638.926 g/mol
Solvent CDCl3
Source File Reference UWCP2595