| SpectraBase Compound ID | B1JFY3NWQSn |
|---|---|
| InChI | InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3 |
| InChIKey | JXLYSJRDGCGARV-UHFFFAOYSA-N |
| Mol Weight | 811.0 g/mol |
| Molecular Formula | C46H58N4O9 |
| Exact Mass | 810.420379 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3myYLAeGFo3 |
|---|---|
| Name | Vinblastine |
| CAS Registry Number | 865-21-4 |
| Comments | MONOPROTONATED SPECIES WITH CF3COOH |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C46H58N4O9 |
| InChI | InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3 |
| InChIKey | JXLYSJRDGCGARV-UHFFFAOYSA-N |
| Instrument Name | Jeol PFT-100 |
| Literature Reference | D.E. Dorman, J.W. Paschal, Org. Magn. Resonance 8, 413 (1976). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |