| SpectraBase Compound ID | K8UhpK2MOFA |
|---|---|
| InChI | InChI=1S/C35H40O9/c1-22(36)33(40)17-18-35(42)31(33,2)28(44-30(39)24-11-7-4-8-12-24)20-27-32(21-43-29(38)23-9-5-3-6-10-23)15-14-26(37)19-25(32)13-16-34(27,35)41/h3-13,26-28,37,40-42H,14-21H2,1-2H3/t26-,27+,28+,31+,32+,33+,34-,35+/m0/s1 |
| InChIKey | KEAJWIWGMUDPLS-UUZOEHEGSA-N |
| Mol Weight | 604.7 g/mol |
| Molecular Formula | C35H40O9 |
| Exact Mass | 604.267233 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8uT35PwxzM2 |
|---|---|
| Name | 12-O-BENZOYL-19-BENZOYLOXYDEACYLMETAPLEXIGENIN |
| Compound Number | 18A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H40O9 |
| InChI | InChI=1S/C35H40O9/c1-22(36)33(40)17-18-35(42)31(33,2)28(44-30(39)24-11-7-4-8-12-24)20-27-32(21-43-29(38)23-9-5-3-6-10-23)15-14-26(37)19-25(32)13-16-34(27,35)41/h3-13,26-28,37,40-42H,14-21H2,1-2H3/t26-,27+,28+,31+,32+,33+,34-,35+/m0/s1 |
| InChIKey | KEAJWIWGMUDPLS-UUZOEHEGSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,1036(2003) |
| Literature Reference DOI | 10.1248/cpb.51.1036 |
| Molecular Weight | 604.697 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU20281 |