| SpectraBase Compound ID | K5YcnkOppmR |
|---|---|
| InChI | InChI=1S/C26H30O12/c1-34-24(33)17-11-36-25(20-14(10-27)5-8-16(17)20)38-26-23(32)22(31)21(30)18(37-26)12-35-19(29)9-4-13-2-6-15(28)7-3-13/h2-7,9,11,16,18,20-23,25-28,30-32H,8,10,12H2,1H3/b9-4+/t16-,18+,20-,21+,22-,23+,25+,26-/m1/s1 |
| InChIKey | IVYAOUHUAWZJDB-NCEOQMGFSA-N |
| Mol Weight | 534.51 g/mol |
| Molecular Formula | C26H30O12 |
| Exact Mass | 534.173726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8mAIpeA3x9V |
|---|---|
| Name | 6'-O-TRANS-PARA-COUMAROYLGENIPOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H30O12 |
| InChI | InChI=1S/C26H30O12/c1-34-24(33)17-11-36-25(20-14(10-27)5-8-16(17)20)38-26-23(32)22(31)21(30)18(37-26)12-35-19(29)9-4-13-2-6-15(28)7-3-13/h2-7,9,11,16,18,20-23,25-28,30-32H,8,10,12H2,1H3/b9-4+/t16-,18+,20-,21+,22-,23+,25+,26-/m1/s1 |
| InChIKey | IVYAOUHUAWZJDB-NCEOQMGFSA-N |
| Literature Reference Author | Y.YU,Z.L.XIE,H.GAO,W.W.MA,Y.DAI,Y.WANG,Y.ZHONG,X.S.YAO |
| Literature Reference Citation | J.NAT.PROD.,72,1459(2009) |
| Literature Reference DOI | 10.1021/np900176q |
| Molecular Weight | 534.517 g/mol |
| Sample ID | 33362 |
| Solvent | CD3OD |