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PANDICINE
SpectraBase Compound ID 5M1Ws01s7is
InChI InChI=1S/C43H48N4O7/c1-6-42-18-25(40(49)52-5)38-43(27-17-32(48)36(50-3)37(51-4)34(27)45-38)13-14-47(41(42)43)29(35-39(42)54-35)12-11-21-19-53-20-26-23(21)15-31-33-24(16-30(26)46(31)2)22-9-7-8-10-28(22)44-33/h7-12,17,19,23,26,29-31,35,39,41,44-45,48H,6,13-16,18,20H2,1-5H3/b12-11+/t23-,26+,29+,30-,31-,35+,39+,41-,42+,43?/m0/s1
InChIKey WTIFYZRBAWDKNG-BSDWXKAMSA-N
Mol Weight 732.9 g/mol
Molecular Formula C43H48N4O7
Exact Mass 732.3523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F2jTTD8Lz0i
Name PANDICINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H48N4O7
InChI InChI=1S/C43H48N4O7/c1-6-42-18-25(40(49)52-5)38-43(27-17-32(48)36(50-3)37(51-4)34(27)45-38)13-14-47(41(42)43)29(35-39(42)54-35)12-11-21-19-53-20-26-23(21)15-31-33-24(16-30(26)46(31)2)22-9-7-8-10-28(22)44-33/h7-12,17,19,23,26,29-31,35,39,41,44-45,48H,6,13-16,18,20H2,1-5H3/b12-11+/t23-,26+,29+,30-,31-,35+,39+,41-,42+,43?/m0/s1
InChIKey WTIFYZRBAWDKNG-BSDWXKAMSA-N
Literature Reference Author T.S.KAM,K.Y.LOH,C.WEI
Literature Reference Citation J.NAT.PROD.,56,1865(1993)
Literature Reference DOI 10.1021/np50101a001
Molecular Weight 732.877 g/mol
Solvent CDCl3
Source File Reference UWCS5044