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2'-[2''-[(INDOL-3''-YL)-METHYLINDOL-3''-ENE]-METHYL]-ASCORBIGEN
SpectraBase Compound ID 3dXJ1fjH8ih
InChI InChI=1S/C33H29N3O6/c37-29-17-41-33(40)30(29)42-31(38)32(33,39)15-23-21-9-3-6-12-26(21)36-28(23)14-22-20-8-2-5-11-25(20)35-27(22)13-18-16-34-24-10-4-1-7-19(18)24/h1-12,16,29-30,34-37,39-40H,13-15,17H2/t29-,30?,32+,33-/m1/s1
InChIKey LKVALFSQLKUOSY-BOOVIFJVSA-N
Mol Weight 563.6 g/mol
Molecular Formula C33H29N3O6
Exact Mass 563.205636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BFyhlvzGgYr
Name 2'-[2''-[(INDOL-3''-YL)-METHYLINDOL-3''-ENE]-METHYL]-ASCORBIGEN
Compound Number III-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H29N3O6
InChI InChI=1S/C33H29N3O6/c37-29-17-41-33(40)30(29)42-31(38)32(33,39)15-23-21-9-3-6-12-26(21)36-28(23)14-22-20-8-2-5-11-25(20)35-27(22)13-18-16-34-24-10-4-1-7-19(18)24/h1-12,16,29-30,34-37,39-40H,13-15,17H2/t29-,30?,32+,33-/m1/s1
InChIKey LKVALFSQLKUOSY-BOOVIFJVSA-N
Literature Reference Author E.I.LAZHKO,A.M.KOROLEV,M.N.PREOBRAZHENSKAYA
Literature Reference Citation CHEM.HET.COMP.,29,295(1993)
Literature Reference DOI 10.1007/bf00531505
Molecular Weight 563.610 g/mol
Solvent CD3OD
Source File Reference UWMZ12514