| SpectraBase Compound ID | D5quK9pJVIs |
|---|---|
| InChI | InChI=1S/C28H30O12/c1-36-18-11-7-10-17(15-37-27(34)28(35)13-6-5-12-20(28)30)23(18)40-26-24(22(32)21(31)19(14-29)38-26)39-25(33)16-8-3-2-4-9-16/h2-4,6-11,13,19,21-22,24,26,29,31-32,35H,5,12,14-15H2,1H3/t19-,21-,22+,24-,26+,28?/m1/s1 |
| InChIKey | UZVCRPMMJNICGD-YPNZVTCWSA-N |
| Mol Weight | 558.54 g/mol |
| Molecular Formula | C28H30O12 |
| Exact Mass | 558.173726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 71z0FaVfuEX |
|---|---|
| Name | COCHINCHISIDE-B-METHYLETHER |
| Compound Number | 5K |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H30O12 |
| InChI | InChI=1S/C28H30O12/c1-36-18-11-7-10-17(15-37-27(34)28(35)13-6-5-12-20(28)30)23(18)40-26-24(22(32)21(31)19(14-29)38-26)39-25(33)16-8-3-2-4-9-16/h2-4,6-11,13,19,21-22,24,26,29,31-32,35H,5,12,14-15H2,1H3/t19-,21-,22+,24-,26+,28?/m1/s1 |
| InChIKey | UZVCRPMMJNICGD-YPNZVTCWSA-N |
| Literature Reference Author | T.ISHIKAWA,K.NISHIGAYA,K.TAKAMI,H.UCHIKOSHI,I.S.CHEN,I.L.TSA I |
| Literature Reference Citation | J.NAT.PROD.,67,659(2004) |
| Literature Reference DOI | 10.1021/np034052o |
| Molecular Weight | 558.539 g/mol |
| Solvent | CDCl3+ONE_DROP_OF_CD3OD |
| Source File Reference | UWMZ7008 |