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VOBTUSINE-3-LACTAME
SpectraBase Compound ID 3OcoBieOJhl
InChI InChI=1S/C43H48N4O7/c1-51-29-9-5-7-27-31(29)47-23-40(21-24-20-38-13-18-53-30(38)10-15-45-16-12-42(27,35(38)45)43(24,47)50)36-39(14-19-54-36)22-25(33(48)52-2)32-41(11-17-46(34(39)41)37(40)49)26-6-3-4-8-28(26)44-32/h3-9,24,30,34-36,44,50H,10-23H2,1-2H3/t24-,30-,34-,35-,36+,38+,39-,40-,41-,42+,43+/m0/s1
InChIKey BZQCAVOSZWOKSM-MFTDSWOISA-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 6ytQnl4oaZp
Name VOBTUSINE-3-LACTAME
CAS Registry Number 50924-04-4
Compound Number 1F
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H48N4O7
InChI InChI=1S/C43H48N4O7/c1-51-29-9-5-7-27-31(29)47-23-40(21-24-20-38-13-18-53-30(38)10-15-45-16-12-42(27,35(38)45)43(24,47)50)36-39(14-19-54-36)22-25(33(48)52-2)32-41(11-17-46(34(39)41)37(40)49)26-6-3-4-8-28(26)44-32/h3-9,24,30,34-36,44,50H,10-23H2,1-2H3/t24-,30-,34-,35-,36+,38+,39-,40-,41-,42+,43+/m0/s1
InChIKey BZQCAVOSZWOKSM-MFTDSWOISA-N
Literature Reference Author Y.ROLLAND,N.KUNESCH,J.POISSON,E.W.HAGAMAN,F.M.SCHELL,E.WENKE RT
Literature Reference Citation J.ORG.CHEM.,41,3270(1976)
Literature Reference DOI 10.1021/jo00882a013
Molecular Weight 732.877 g/mol
Solvent CDCl3
Source File Reference UWRK2494