| SpectraBase Compound ID | EHBtVD8xuz8 |
|---|---|
| InChI | InChI=1S/C34H45NO5/c1-20(28(18-34(6)31(2,3)40-34)39-30(38)21-8-7-15-35-19-21)24-9-10-25-29-26(12-14-33(24,25)5)32(4)13-11-23(36)16-22(32)17-27(29)37/h7-8,11,13,15-16,19-20,24-29,37H,9-10,12,14,17-18H2,1-6H3/t20-,24+,25?,26?,27?,28+,29?,32-,33+,34-/m1/s1 |
| InChIKey | MDUKOTUMOLLGQF-RTOUSNQMSA-N |
| Mol Weight | 547.7 g/mol |
| Molecular Formula | C34H45NO5 |
| Exact Mass | 547.329774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BfOW1ssiMsi |
|---|---|
| Name | PETUNIASTERONE C 22-NICOTINATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C34H45NO5 |
| InChI | InChI=1S/C34H45NO5/c1-20(28(18-34(6)31(2,3)40-34)39-30(38)21-8-7-15-35-19-21)24-9-10-25-29-26(12-14-33(24,25)5)32(4)13-11-23(36)16-22(32)17-27(29)37/h7-8,11,13,15-16,19-20,24-29,37H,9-10,12,14,17-18H2,1-6H3/t20-,24+,25?,26?,27?,28+,29?,32-,33+,34-/m1/s1 |
| InChIKey | MDUKOTUMOLLGQF-RTOUSNQMSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |