| SpectraBase Compound ID | FNN9qFIYwaO |
|---|---|
| InChI | InChI=1S/C26H36O14/c1-26(2)8-7-12-13(40-26)5-3-11(4-6-16(28)29)23(12)39-25-22(35)20(33)18(31)15(38-25)10-36-24-21(34)19(32)17(30)14(9-27)37-24/h3,5,7-8,14-15,17-22,24-25,27,30-35H,4,6,9-10H2,1-2H3,(H,28,29)/t14-,15-,17-,18-,19+,20+,21-,22-,24-,25+/m1/s1 |
| InChIKey | NQAQCZORTDQVFT-LMYULTQQSA-N |
| Mol Weight | 572.6 g/mol |
| Molecular Formula | C26H36O14 |
| Exact Mass | 572.210506 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HixV6i2V9PD |
|---|---|
| Name | OMUBIOSIDE;8A-(O-BETA-GENTIOBIOSYLOXY)-7,8-(9,9-DIMETHYLPYRANO)-HYDROCOUMARIC_ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H36O14 |
| InChI | InChI=1S/C26H36O14/c1-26(2)8-7-12-13(40-26)5-3-11(4-6-16(28)29)23(12)39-25-22(35)20(33)18(31)15(38-25)10-36-24-21(34)19(32)17(30)14(9-27)37-24/h3,5,7-8,14-15,17-22,24-25,27,30-35H,4,6,9-10H2,1-2H3,(H,28,29)/t14-,15-,17-,18-,19+,20+,21-,22-,24-,25+/m1/s1 |
| InChIKey | NQAQCZORTDQVFT-LMYULTQQSA-N |
| Literature Reference Author | D.LACROIX,S.PRADO,D.KAMOGA,J.KASENENE,B.BODO |
| Literature Reference Citation | J.NAT.PROD.,74,2286(2011) |
| Literature Reference DOI | 10.1021/np2004825 |
| Molecular Weight | 572.563 g/mol |
| Sample ID | 39490 |
| Solvent | CD3OD |