| SpectraBase Compound ID | BQSrGHrGRjF |
|---|---|
| InChI | InChI=1S/C17H24O11.Na/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17;/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20);/q;+1/p-1/t7-,8+,10+,12+,13-,14+,16+,17-;/m1./s1 |
| InChIKey | HPBIKFKOJFRCRA-NNGFYJHFSA-M |
| Mol Weight | 426.35 g/mol |
| Molecular Formula | C17H23NaO11 |
| Exact Mass | 426.113806 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JpcUWs4VHFG |
|---|---|
| Name | SECOXYLOGANIN-SODIUM-SALT |
| Compound Number | 2' |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H23NaO11 |
| InChI | InChI=1S/C17H24O11.Na/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17;/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20);/q;+1/p-1/t7-,8+,10+,12+,13-,14+,16+,17-;/m1./s1 |
| InChIKey | HPBIKFKOJFRCRA-NNGFYJHFSA-M |
| Literature Reference Author | K.MACHIDA,E.UNAGAMI,H.OJIMA,M.KIKUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,883(2003) |
| Literature Reference DOI | 10.1248/cpb.51.883 |
| Molecular Weight | 426.353 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU20098 |