| SpectraBase Compound ID | 1ifPZXCkm1D |
|---|---|
| InChI | InChI=1S/C33H54O9/c1-17(24(35)10-11-30(3,4)42-29-28(39)27(38)26(37)18(2)41-29)20-9-14-33(40)22-16-25(36)23-15-19(34)7-12-31(23,5)21(22)8-13-32(20,33)6/h16-21,23-24,26-29,34-35,37-40H,7-15H2,1-6H3/t17-,18-,19-,20+,21-,23-,24+,26-,27+,28+,29-,31+,32+,33+/m0/s1 |
| InChIKey | BDKGGTGFHVGEHI-RKJBTMRNSA-N |
| Mol Weight | 594.8 g/mol |
| Molecular Formula | C33H54O9 |
| Exact Mass | 594.376783 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7LfWqmAQGPl |
|---|---|
| Name | 2-DEOXY-ECDYSONE-25-ALPHA-L-RHAMNOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H54O9 |
| InChI | InChI=1S/C33H54O9/c1-17(24(35)10-11-30(3,4)42-29-28(39)27(38)26(37)18(2)41-29)20-9-14-33(40)22-16-25(36)23-15-19(34)7-12-31(23,5)21(22)8-13-32(20,33)6/h16-21,23-24,26-29,34-35,37-40H,7-15H2,1-6H3/t17-,18-,19-,20+,21-,23-,24+,26-,27+,28+,29-,31+,32+,33+/m0/s1 |
| InChIKey | BDKGGTGFHVGEHI-RKJBTMRNSA-N |
| Literature Reference Author | R.HO,J.P.GIRAULT,P.Y.COUSTEAU,J.P.BIANCHINI,P.RAHARIVELOMANA NA,R.LAFONT |
| Literature Reference Citation | J.CHROMAT.SCI.,46,102(2008) |
| Literature Reference DOI | 10.1093/chromsci/46.2.102 |
| Molecular Weight | 594.786 g/mol |
| Solvent | C5D5N:D2O |
| Source File Reference | UWLU76377 |