| SpectraBase Compound ID | Jc3ZN4pJLYY |
|---|---|
| InChI | InChI=1S/C27H38O13/c1-10-5-6-13(18(10)23(32)33)11(2)24(34)38-16-7-14-15(25(35)36-4)9-37-26(19(14)12(16)3)40-27-22(31)21(30)20(29)17(8-28)39-27/h9-10,12-14,16-22,26-31H,2,5-8H2,1,3-4H3,(H,32,33)/t10-,12-,13?,14?,16-,17-,18?,19?,20-,21+,22-,26-,27+/m0/s1 |
| InChIKey | RWSSZTKTFVPWDZ-JUOUAOPFSA-N |
| Mol Weight | 570.6 g/mol |
| Molecular Formula | C27H38O13 |
| Exact Mass | 570.231241 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GMDXXYUQ76j |
|---|---|
| Name | ASPERULOIDE-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38O13 |
| InChI | InChI=1S/C27H38O13/c1-10-5-6-13(18(10)23(32)33)11(2)24(34)38-16-7-14-15(25(35)36-4)9-37-26(19(14)12(16)3)40-27-22(31)21(30)20(29)17(8-28)39-27/h9-10,12-14,16-22,26-31H,2,5-8H2,1,3-4H3,(H,32,33)/t10-,12-,13?,14?,16-,17-,18?,19?,20-,21+,22-,26-,27+/m0/s1 |
| InChIKey | RWSSZTKTFVPWDZ-JUOUAOPFSA-N |
| Literature Reference Author | A.PARK,H.J.KIM,J.S.LEE,E.R.WOO,H.PARK,Y.S.LEE |
| Literature Reference Citation | J.NAT.PROD.,65,1363(2002) |
| Literature Reference DOI | 10.1021/np020017q |
| Molecular Weight | 570.591 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI5256 |