| SpectraBase Compound ID | J6ZlACBXYS9 |
|---|---|
| InChI | InChI=1S/C29H36O9/c1-15(30)37-25-26(2,3)20(12-21(31)35-6)28(5)18-7-9-27(4)19(17(18)13-29(25,34)24(28)33)11-22(32)38-23(27)16-8-10-36-14-16/h8,10,13-14,18-20,23,25,34H,7,9,11-12H2,1-6H3/t18?,19?,20-,23-,25-,27+,28-,29+/m0/s1 |
| InChIKey | ODHSWYNEXJIJEI-QXMQRHJZSA-N |
| Mol Weight | 528.6 g/mol |
| Molecular Formula | C29H36O9 |
| Exact Mass | 528.235933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H0odawqXtJz |
|---|---|
| Name | 2-HYDROXY-DESTIGLOYL-6-DEOXYSWIETENINE-ACETATE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H36O9 |
| InChI | InChI=1S/C29H36O9/c1-15(30)37-25-26(2,3)20(12-21(31)35-6)28(5)18-7-9-27(4)19(17(18)13-29(25,34)24(28)33)11-22(32)38-23(27)16-8-10-36-14-16/h8,10,13-14,18-20,23,25,34H,7,9,11-12H2,1-6H3/t18?,19?,20-,23-,25-,27+,28-,29+/m0/s1 |
| InChIKey | ODHSWYNEXJIJEI-QXMQRHJZSA-N |
| Literature Reference Author | D.A.MULHOLLAND,D.A.H.TAYLOR |
| Literature Reference Citation | PHYTOCHEM.,31,4163(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80434-G |
| Molecular Weight | 528.599 g/mol |
| Solvent | Unknown |
| Source File Reference | UWMS27840 |