| SpectraBase Compound ID | AwWYPMJF4c3 |
|---|---|
| InChI | InChI=1S/C28H30O9/c1-13-19(30)35-18-12-23(13,2)20-27(34)16-9-8-14-6-5-7-17(29)24(14,3)15(16)10-11-26(33)21(31)36-25(18,4)28(20,26)37-22(27)32/h5-9,13,15-16,18,20,33-34H,10-12H2,1-4H3/t13?,15-,16-,18?,20-,23?,24-,25?,26+,27+,28+/m0/s1 |
| InChIKey | NSFHPMKDYVTYOY-KOOOQMGLSA-N |
| Mol Weight | 510.54 g/mol |
| Molecular Formula | C28H30O9 |
| Exact Mass | 510.188983 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FQAuW7ArW45 |
|---|---|
| Name | (25S)-25,27-Dihydro-4,7-didehydro-7-deoxy-neophysalin A |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H30O9 |
| InChI | InChI=1S/C28H30O9/c1-13-19(30)35-18-12-23(13,2)20-27(34)16-9-8-14-6-5-7-17(29)24(14,3)15(16)10-11-26(33)21(31)36-25(18,4)28(20,26)37-22(27)32/h5-9,13,15-16,18,20,33-34H,10-12H2,1-4H3/t13?,15-,16-,18?,20-,23?,24-,25?,26+,27+,28+/m0/s1 |
| InChIKey | NSFHPMKDYVTYOY-KOOOQMGLSA-N |
| Instrument Name | Jeol GX-400 |
| Literature Reference | M. Kawai, T. Ogura, Y. Butsugan, Tetrahedron 47, 2103 (1991). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |