| SpectraBase Compound ID | HiZe58MaaqT |
|---|---|
| InChI | InChI=1S/C33H42O12/c1-6-16(2)27(38)30(39)44-29-28(43-15-34)26-18(25-20(35)9-19(32(25,29)4)17-7-8-40-12-17)13-41-22-11-24(37)45-31(3)14-42-23(36)10-21(31)33(22,26)5/h7-8,12,15-16,19-22,26-29,35,38H,6,9-11,13-14H2,1-5H3/t16?,19-,20+,21-,22-,26+,27?,28+,29-,31+,32-,33+/m0/s1 |
| InChIKey | IGAWJAFLFPMXQD-YHNBCYQNSA-N |
| Mol Weight | 630.7 g/mol |
| Molecular Formula | C33H42O12 |
| Exact Mass | 630.267627 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I6WgFES9NyY |
|---|---|
| Name | CIPADESSALIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42O12 |
| InChI | InChI=1S/C33H42O12/c1-6-16(2)27(38)30(39)44-29-28(43-15-34)26-18(25-20(35)9-19(32(25,29)4)17-7-8-40-12-17)13-41-22-11-24(37)45-31(3)14-42-23(36)10-21(31)33(22,26)5/h7-8,12,15-16,19-22,26-29,35,38H,6,9-11,13-14H2,1-5H3/t16?,19-,20+,21-,22-,26+,27?,28+,29-,31+,32-,33+/m0/s1 |
| InChIKey | IGAWJAFLFPMXQD-YHNBCYQNSA-N |
| Literature Reference Author | L.G.LIN,C.P.TANG,C.Q.KE,Y.ZHANG,Y.YE |
| Literature Reference Citation | J.NAT.PROD.,71,628(2008) |
| Literature Reference DOI | 10.1021/np070674o |
| Molecular Weight | 630.689 g/mol |
| Sample ID | 28136 |
| Solvent | CDCl3 |