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BATZELLADINE-A

View entire compound with spectra: 1 NMR

BATZELLADINE-A
SpectraBase Compound ID JQZb2P4QHs6
InChI InChI=1S/C42H73N9O4/c1-3-4-5-6-8-11-14-20-31-29-32-23-24-35-36(30(2)47-42(48-31)51(32)35)38(52)54-27-17-13-10-7-9-12-15-21-33-37(34-22-19-26-50(34)41(45)49-33)39(53)55-28-18-16-25-46-40(43)44/h30-33,35-36H,3-29H2,1-2H3,(H2,45,49)(H,47,48)(H4,43,44,46)/t30-,31+,32-,33?,35+,36+/m0/s1
InChIKey WZGMBJKFYVONHF-LLVPUWIYSA-N
Mol Weight 768.1 g/mol
Molecular Formula C42H73N9O4
Exact Mass 767.578552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7HxFNjpV4j6
Name BATZELLADINE-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H73N9O4
InChI InChI=1S/C42H73N9O4/c1-3-4-5-6-8-11-14-20-31-29-32-23-24-35-36(30(2)47-42(48-31)51(32)35)38(52)54-27-17-13-10-7-9-12-15-21-33-37(34-22-19-26-50(34)41(45)49-33)39(53)55-28-18-16-25-46-40(43)44/h30-33,35-36H,3-29H2,1-2H3,(H2,45,49)(H,47,48)(H4,43,44,46)/t30-,31+,32-,33?,35+,36+/m0/s1
InChIKey WZGMBJKFYVONHF-LLVPUWIYSA-N
Literature Reference Author A.D.PATIL,N.V.KUMAR,W.C.KOKKE,M.F.BEAN,A.J.FREYER,C.DEBROSSE ,S.MAI,A.TRUNEH,D.J.
Literature Reference Citation J.ORG.CHEM.,60,1182(1995)
Literature Reference DOI 10.1021/jo00110a021
Molecular Weight 768.100 g/mol
Solvent METHANOL-D4
Source File Reference UWGE501