| SpectraBase Compound ID | AefWSZ5s5MR |
|---|---|
| InChI | InChI=1S/C36H49N5O5/c1-7-23(3)30-34(43)37-20-18-25-14-16-27(17-15-25)46-29-19-21-41(32(29)35(44)38-30)36(45)31(24(4)8-2)39-33(42)28(40(5)6)22-26-12-10-9-11-13-26/h9-18,20,23-24,28-32H,7-8,19,21-22H2,1-6H3,(H,37,43)(H,38,44)(H,39,42)/b20-18- |
| InChIKey | VNEXXKFUERBRNG-ZZEZOPTASA-N |
| Mol Weight | 631.8 g/mol |
| Molecular Formula | C36H49N5O5 |
| Exact Mass | 631.37337 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6z99HfpbYPe |
|---|---|
| Name | Amphibin-D |
| CAS Registry Number | 38496-02-5 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H49N5O5 |
| InChI | InChI=1S/C36H49N5O5/c1-7-23(3)30-34(43)37-20-18-25-14-16-27(17-15-25)46-29-19-21-41(32(29)35(44)38-30)36(45)31(24(4)8-2)39-33(42)28(40(5)6)22-26-12-10-9-11-13-26/h9-18,20,23-24,28-32H,7-8,19,21-22H2,1-6H3,(H,37,43)(H,38,44)(H,39,42)/b20-18- |
| InChIKey | VNEXXKFUERBRNG-ZZEZOPTASA-N |
| Literature Reference | Liebigs Ann. Chem. 447 (1980). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |