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NXSLVAZXWIJDBK-MTGOPFLASA-N
SpectraBase Compound ID 8eH67WRECVn
InChI InChI=1S/C49H51N7O11/c1-29-26-55(47(61)53-43(29)58)41-23-37(40(67-41)28-65-49(32-13-9-6-10-14-32,33-15-19-35(63-3)20-16-33)34-17-21-36(64-4)22-18-34)51-46(52-45(60)31-11-7-5-8-12-31)50-25-39-38(57)24-42(66-39)56-27-30(2)44(59)54-48(56)62/h5-22,26-27,37-42,57H,23-25,28H2,1-4H3,(H,53,58,61)(H,54,59,62)(H2,50,51,52,60)/t37-,38+,39-,40+,41+,42-/m1/s1
InChIKey NXSLVAZXWIJDBK-MTGOPFLASA-N
Mol Weight 914.0 g/mol
Molecular Formula C49H51N7O11
Exact Mass 913.364655 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5CWUwNg4kfE
Name NXSLVAZXWIJDBK-MTGOPFLASA-N
Compound Number 6G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C49H51N7O11
InChI InChI=1S/C49H51N7O11/c1-29-26-55(47(61)53-43(29)58)41-23-37(40(67-41)28-65-49(32-13-9-6-10-14-32,33-15-19-35(63-3)20-16-33)34-17-21-36(64-4)22-18-34)51-46(52-45(60)31-11-7-5-8-12-31)50-25-39-38(57)24-42(66-39)56-27-30(2)44(59)54-48(56)62/h5-22,26-27,37-42,57H,23-25,28H2,1-4H3,(H,53,58,61)(H,54,59,62)(H2,50,51,52,60)/t37-,38+,39-,40+,41+,42-/m1/s1
InChIKey NXSLVAZXWIJDBK-MTGOPFLASA-N
Literature Reference Author F.VANDENDRIESSCHE,A.VANAERSCHOT,M.VOORTMANS,G.JANSSEN,R.BUSS ON,A.VANOVERBEKE,W.V
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1567(1993)
Literature Reference DOI 10.1039/p19930001567
Molecular Weight 913.984 g/mol
Solvent CDCl3
Source File Reference UWCP6724