| SpectraBase Compound ID | 3XB3qUEOdRD |
|---|---|
| InChI | InChI=1S/C27H34O12/c1-3-17-18(10-16-8-15(30)9-20(37-16)13-4-6-14(29)7-5-13)19(25(34)35-2)12-36-26(17)39-27-24(33)23(32)22(31)21(11-28)38-27/h3-7,12,16-18,20-24,26-29,31-33H,1,8-11H2,2H3/t16-,17+,18-,20-,21-,22-,23+,24-,26-,27+/m0/s1 |
| InChIKey | CWRAQHOZLCMDKY-HFAKSNAISA-N |
| Mol Weight | 550.6 g/mol |
| Molecular Formula | C27H34O12 |
| Exact Mass | 550.205027 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9ukRNuk4nFO |
|---|---|
| Name | HYDRACHOSIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H34O12 |
| InChI | InChI=1S/C27H34O12/c1-3-17-18(10-16-8-15(30)9-20(37-16)13-4-6-14(29)7-5-13)19(25(34)35-2)12-36-26(17)39-27-24(33)23(32)22(31)21(11-28)38-27/h3-7,12,16-18,20-24,26-29,31-33H,1,8-11H2,2H3/t16-,17+,18-,20-,21-,22-,23+,24-,26-,27+/m0/s1 |
| InChIKey | CWRAQHOZLCMDKY-HFAKSNAISA-N |
| Literature Reference Author | F.R.CHANG,Y.H.LEE,Y.L.YANG,P.W.HSIEH,A.T.KHALIL,C.Y.CHEN,Y.C .WU |
| Literature Reference Citation | J.NAT.PROD.,66,1245(2003) |
| Literature Reference DOI | 10.1021/np0302394 |
| Molecular Weight | 550.560 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSP1020 |