SpectraBase Compound ID | 1dgMeoRxhOZ |
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InChI | InChI=1S/C43H48N4O8/c1-52-29-9-5-7-27-31(29)46-23-40(21-24-20-38-13-18-54-30(38)10-16-47(51)17-12-42(27,35(38)47)43(24,46)50)36-39(14-19-55-36)22-25(33(48)53-2)32-41(11-15-45(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?,47+/m1/s1 |
InChIKey | CUSQNXIDWSRALE-UHFFFAOYSA-N |
Mol Weight | 748.9 g/mol |
Molecular Formula | C43H48N4O8 |
Exact Mass | 748.347215 g/mol |
SpectraBase Spectrum ID | AeDotz5yLVO |
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Name | Vobtusine 3-lactam N(B')-oxide |
CAS Registry Number | 50924-05-5 |
Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula | C43H48N4O8 |
InChI | InChI=1S/C43H48N4O8/c1-52-29-9-5-7-27-31(29)46-23-40(21-24-20-38-13-18-54-30(38)10-16-47(51)17-12-42(27,35(38)47)43(24,46)50)36-39(14-19-55-36)22-25(33(48)53-2)32-41(11-15-45(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 |
InChIKey | CUSQNXIDWSRALE-UHFFFAOYSA-N |
Instrument Name | Varian XL-100 |
Literature Reference | Y. Rolland, N. Kunesch, E. Wenkert, J. Org. Chem. 41, 3270 (1976). |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |