| SpectraBase Compound ID | CnKSTpxtuFz |
|---|---|
| InChI | InChI=1S/C27H44O9/c1-23(34,13-28)7-6-21(33)26(4,35)20-5-8-27(36)15-10-16(29)14-9-17(30)18(31)11-24(14,2)22(15)19(32)12-25(20,27)3/h10,14,17-22,28,30-36H,5-9,11-13H2,1-4H3/t14-,17+,18-,19+,20-,21+,22?,23?,24-,25+,26-,27+/m0/s1 |
| InChIKey | KLDBEDBIBHZKCM-LTCIMYQDSA-N |
| Mol Weight | 512.6 g/mol |
| Molecular Formula | C27H44O9 |
| Exact Mass | 512.298533 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3vDLBxM9Kxl |
|---|---|
| Name | 11-ALPHA,20,26-TRIHYDROXYECDYSONE;EPIMER-1 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O9 |
| InChI | InChI=1S/C27H44O9/c1-23(34,13-28)7-6-21(33)26(4,35)20-5-8-27(36)15-10-16(29)14-9-17(30)18(31)11-24(14,2)22(15)19(32)12-25(20,27)3/h10,14,17-22,28,30-36H,5-9,11-13H2,1-4H3/t14-,17+,18-,19+,20-,21+,22?,23?,24-,25+,26-,27+/m0/s1 |
| InChIKey | KLDBEDBIBHZKCM-LTCIMYQDSA-N |
| Literature Reference Author | A.SUKSAMRARN,N.PROMRANGSAN,A.JINTASIRIKUL |
| Literature Reference Citation | PHYTOCHEM.,53,921(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00458-6 |
| Molecular Weight | 512.641 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU2228 |