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METHYL-(1S,3S)-16-(2-BENZOYL-3-METHOXYCARBONYL-1,2,3,4-TETRAHYDRO-BETA-CARBOLIN-1-YL)-15,16-EPOXY-8(17),13(16),14-LABDATRIEN-18-OATE

View entire compound with spectra: 1 NMR

METHYL-(1S,3S)-16-(2-BENZOYL-3-METHOXYCARBONYL-1,2,3,4-TETRAHYDRO-BETA-CARBOLIN-1-YL)-15,16-EPOXY-8(17),13(16),14-LABDATRIEN-18-OATE
SpectraBase Compound ID Hj1xrMiZRB6
InChI InChI=1S/C41H46N2O6/c1-25-16-19-33-40(2,21-11-22-41(33,3)39(46)48-5)30(25)18-17-26-20-23-49-36(26)35-34-29(28-14-9-10-15-31(28)42-34)24-32(38(45)47-4)43(35)37(44)27-12-7-6-8-13-27/h6-10,12-15,20,23,30,32-33,35,42H,1,11,16-19,21-22,24H2,2-5H3/t30-,32-,33?,35+,40+,41-/m1/s1
InChIKey FJBJETUSFQOWJB-QXXZWJPKSA-N
Mol Weight 662.8 g/mol
Molecular Formula C41H46N2O6
Exact Mass 662.335587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9q25Itd9x79
Name METHYL-(1S,3S)-16-(2-BENZOYL-3-METHOXYCARBONYL-1,2,3,4-TETRAHYDRO-BETA-CARBOLIN-1-YL)-15,16-EPOXY-8(17),13(16),14-LABDATRIEN-18-OATE
Compound Number VII
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H46N2O6
InChI InChI=1S/C41H46N2O6/c1-25-16-19-33-40(2,21-11-22-41(33,3)39(46)48-5)30(25)18-17-26-20-23-49-36(26)35-34-29(28-14-9-10-15-31(28)42-34)24-32(38(45)47-4)43(35)37(44)27-12-7-6-8-13-27/h6-10,12-15,20,23,30,32-33,35,42H,1,11,16-19,21-22,24H2,2-5H3/t30-,32-,33?,35+,40+,41-/m1/s1
InChIKey FJBJETUSFQOWJB-QXXZWJPKSA-N
Literature Reference Author S.V.CHERNOV,E.E.SHULTS,M.M.SHAKIROV,G.A.TOLSTIKOV
Literature Reference Citation RUSS.J.ORG.CHEM.,38,665(2002)
Literature Reference DOI 10.1023/A:1019607005053
Molecular Weight 662.826 g/mol
Solvent CDCl3