| SpectraBase Compound ID | Fy0PJYnJzGJ |
|---|---|
| InChI | InChI=1S/C32H50O7/c1-18-36-23-16-21-22(33)15-20-19(29(21,6)17-24(23)37-18)9-13-30(7)25(10-14-32(20,30)35)31(8)26(11-12-27(2,3)34)38-28(4,5)39-31/h15,18-19,21,23-26,34-35H,9-14,16-17H2,1-8H3/t18-,19+,21+,23-,24+,25+,26-,29-,30-,31-,32-/m1/s1 |
| InChIKey | MTLPEDFGQPIHBS-RINJXUFZSA-N |
| Mol Weight | 546.7 g/mol |
| Molecular Formula | C32H50O7 |
| Exact Mass | 546.355654 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DUTdvKQjeYg |
|---|---|
| Name | 28-BETA,29,29-TRIMETHYL-2,3;20,22-BIS-O-METHYLIDENE-20-HYDROXY-ECDYSONE |
| Compound Number | 26 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O7 |
| InChI | InChI=1S/C32H50O7/c1-18-36-23-16-21-22(33)15-20-19(29(21,6)17-24(23)37-18)9-13-30(7)25(10-14-32(20,30)35)31(8)26(11-12-27(2,3)34)38-28(4,5)39-31/h15,18-19,21,23-26,34-35H,9-14,16-17H2,1-8H3/t18-,19+,21+,23-,24+,25+,26-,29-,30-,31-,32-/m1/s1 |
| InChIKey | MTLPEDFGQPIHBS-RINJXUFZSA-N |
| Literature Reference Author | A.MARTINS,J.CSABI,A.BALAZS,D.KITKA,L.AMARAL,J.MOLNAR,A.SIMON ,G.TOTH,A.HUNYADI |
| Literature Reference Citation | MOLECULES,18,15255(2013) |
| Literature Reference DOI | 10.3390/molecules181215255 |
| Molecular Weight | 546.745 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWIR9979 |