| SpectraBase Compound ID | 2UJnGODiKm3 |
|---|---|
| InChI | InChI=1S/C36H56O11/c1-31(2)11-13-36(30(45)47-29-26(42)25(41)24(40)20(16-37)46-29)14-12-34(5)18(23(36)28(31)44)7-8-22-32(3)15-19(39)27(43)33(4,17-38)21(32)9-10-35(22,34)6/h7,17,19-29,37,39-44H,8-16H2,1-6H3/t19-,20-,21?,22?,23-,24-,25+,26-,27+,28+,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | YINNEDVQUNYQEZ-BOTMRVARSA-N |
| Mol Weight | 664.8 g/mol |
| Molecular Formula | C36H56O11 |
| Exact Mass | 664.382263 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7ltPRThKfAK |
|---|---|
| Name | PARADRYMONIN;2-ALPHA,3-BETA,19-ALPHA-TRIHYDROXY-24-OXO-OLEAN-12-EN-28-O-BETA-GLUCOPYRANOSYLESTER |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O11 |
| InChI | InChI=1S/C36H56O11/c1-31(2)11-13-36(30(45)47-29-26(42)25(41)24(40)20(16-37)46-29)14-12-34(5)18(23(36)28(31)44)7-8-22-32(3)15-19(39)27(43)33(4,17-38)21(32)9-10-35(22,34)6/h7,17,19-29,37,39-44H,8-16H2,1-6H3/t19-,20-,21?,22?,23-,24-,25+,26-,27+,28+,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | YINNEDVQUNYQEZ-BOTMRVARSA-N |
| Literature Reference Author | C.TERREAUX,M.P.MAILLARD,M.P.GUPTA,K.HOSTETTMANN |
| Literature Reference Citation | PHYTOCHEM.,42,495(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00945-0 |
| Molecular Weight | 664.834 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU3367 |