| SpectraBase Compound ID | 7w708Dy0F9M |
|---|---|
| InChI | InChI=1S/C36H52O11/c1-17(2)9-12-24(39)36(8,45)29-20(38)14-33(5)23-11-10-18-19(35(23,7)25(40)15-34(29,33)6)13-21(30(44)32(18,3)4)46-31-28(43)27(42)26(41)22(16-37)47-31/h10,13,19-20,22-23,26-29,31,37-38,41-43,45H,1,9,11-12,14-16H2,2-8H3/t19-,20-,22+,23+,26+,27-,28+,29+,31+,33+,34-,35+,36+/m1/s1 |
| InChIKey | STJBLNHSRWHURW-GTPNJKORSA-N |
| Mol Weight | 660.8 g/mol |
| Molecular Formula | C36H52O11 |
| Exact Mass | 660.350962 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BHK5qDMr4Tv |
|---|---|
| Name | KHEKADAENGOSIDE-C |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H52O11 |
| InChI | InChI=1S/C36H52O11/c1-17(2)9-12-24(39)36(8,45)29-20(38)14-33(5)23-11-10-18-19(35(23,7)25(40)15-34(29,33)6)13-21(30(44)32(18,3)4)46-31-28(43)27(42)26(41)22(16-37)47-31/h10,13,19-20,22-23,26-29,31,37-38,41-43,45H,1,9,11-12,14-16H2,2-8H3/t19-,20-,22+,23+,26+,27-,28+,29+,31+,33+,34-,35+,36+/m1/s1 |
| InChIKey | STJBLNHSRWHURW-GTPNJKORSA-N |
| Literature Reference Author | T.KANCHANAPOOM,R.KASAI,K.YAMASAKI |
| Literature Reference Citation | PHYTOCHEM.,59,215(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00430-7 |
| Molecular Weight | 660.802 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN2544 |