| SpectraBase Compound ID | Ehkp35ji5FL |
|---|---|
| InChI | InChI=1S/C27H30O16/c1-8-15(31)19(35)22(38)26(39-8)43-25-20(36)16(32)13(7-28)41-27(25)40-12-6-11(30)14-18(34)21(37)23(42-24(14)17(12)33)9-2-4-10(29)5-3-9/h2-6,8,13,15-16,19-20,22,25-33,35-38H,7H2,1H3/t8-,13+,15-,16+,19+,20-,22+,25+,26-,27+/m1/s1 |
| InChIKey | IDOWQUCMZMQMEJ-ODTUESCXSA-N |
| Mol Weight | 610.52 g/mol |
| Molecular Formula | C27H30O16 |
| Exact Mass | 610.153385 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BqGKJaKR5yw |
|---|---|
| Name | HERBACETIN-7-O-NEOHESPERIDOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O16 |
| InChI | InChI=1S/C27H30O16/c1-8-15(31)19(35)22(38)26(39-8)43-25-20(36)16(32)13(7-28)41-27(25)40-12-6-11(30)14-18(34)21(37)23(42-24(14)17(12)33)9-2-4-10(29)5-3-9/h2-6,8,13,15-16,19-20,22,25-33,35-38H,7H2,1H3/t8-,13+,15-,16+,19+,20-,22+,25+,26-,27+/m1/s1 |
| InChIKey | IDOWQUCMZMQMEJ-ODTUESCXSA-N |
| Literature Reference Author | Y.AMAKURA,M.YOSHIMURA,S.YAMAKAMI,T.YOSHIDA,D.WAKANA,M.HYUGA, S.HYUGA,T.HANAWA |
| Literature Reference Citation | MOLECULES,18,5326(2013) |
| Literature Reference DOI | 10.3390/molecules18055326 |
| Molecular Weight | 610.526 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT9232 |