| SpectraBase Compound ID | ABV60DlSWi0 |
|---|---|
| InChI | InChI=1S/C42H64O14/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-30(43)23-37-39(41(52)54-4)36(49)26-42(53,56-37)25-33(46)22-35(48)34(47)20-19-31(44)21-32(45)24-38(50)55-29(3)28(2)40(27)51/h5-18,27-37,39-40,43-49,51,53H,19-26H2,1-4H3/b6-5+,9-7-,10-8+,13-11+,14-12+,17-15+,18-16+ |
| InChIKey | CZXDSUCOJBVDNS-QJIWFLFNSA-N |
| Mol Weight | 793.0 g/mol |
| Molecular Formula | C42H64O14 |
| Exact Mass | 792.429607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DhwaLndH0E2 |
|---|---|
| Name | Amphoteronolide B methyl ester |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C42H64O14 |
| InChI | InChI=1S/C42H64O14/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-30(43)23-37-39(41(52)54-4)36(49)26-42(53,56-37)25-33(46)22-35(48)34(47)20-19-31(44)21-32(45)24-38(50)55-29(3)28(2)40(27)51/h5-18,27-37,39-40,43-49,51,53H,19-26H2,1-4H3/b6-5+,9-7-,10-8+,13-11+,14-12+,17-15+,18-16+ |
| InChIKey | CZXDSUCOJBVDNS-QJIWFLFNSA-N |
| Instrument Name | Bruker AM-500 |
| Literature Reference | K.C. Nicolaou, T.K. Chakraborty, Y.Ogawa, J. Am. Chem. Soc. 110, 4660 (1988). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |