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GRACILAMIDE_B
SpectraBase Compound ID 2GUaTuI0ckH
InChI InChI=1S/C43H85NO5/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-29-33-40(46)42(48)39(36-45)44-43(49)41(47)34-30-27-24-23-25-28-32-38-35-37(38)31-6-4-2/h37-42,45-48H,3-36H2,1-2H3,(H,44,49)/t37?,38?,39-,40-,41-,42+/m1/s1
InChIKey IMLLASGEPYOFKY-XAHFBHQNSA-N
Mol Weight 696.2 g/mol
Molecular Formula C43H85NO5
Exact Mass 695.642775 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AgXFXv7OpCK
Name GRACILAMIDE_B
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H85NO5
InChI InChI=1S/C43H85NO5/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-29-33-40(46)42(48)39(36-45)44-43(49)41(47)34-30-27-24-23-25-28-32-38-35-37(38)31-6-4-2/h37-42,45-48H,3-36H2,1-2H3,(H,44,49)/t37?,38?,39-,40-,41-,42+/m1/s1
InChIKey IMLLASGEPYOFKY-XAHFBHQNSA-N
Literature Reference Author Y.SUN,Y.XU,K.LIU,H.HUA,H.ZHU,Y.PEI
Literature Reference Citation J.NAT.PROD.,69,1488(2006)
Literature Reference DOI 10.1021/np060043e
Molecular Weight 696.152 g/mol
Solvent C5D5N
Source File Reference UWMZ15841