| SpectraBase Compound ID | FNaCB9wZgkX |
|---|---|
| InChI | InChI=1S/C40H74O10/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-32(39(47)48)29-33(42)27-25-28-34(43)31-49-40-38(46)37(45)36(44)35(30-41)50-40/h25-26,28,33-38,40-46H,2-24,27,29-31H2,1H3,(H,47,48)/b28-25+,32-26-/t33-,34+,35-,36-,37+,38-,40-/m0/s1 |
| InChIKey | UJPWQNSWFSMAKJ-HJPACQKESA-N |
| Mol Weight | 715.0 g/mol |
| Molecular Formula | C40H74O10 |
| Exact Mass | 714.528199 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9aMDPJFeLQt |
|---|---|
| Name | CALODENDROSIDE-B;(3E,8Z)-8-CARBOXY-1-(O-BETA-D-GLUCOPYRANOSYL)-2,6-DIHYDROXY-TRITRIACONTA-3,8-DIENE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H74O10 |
| InChI | InChI=1S/C40H74O10/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-32(39(47)48)29-33(42)27-25-28-34(43)31-49-40-38(46)37(45)36(44)35(30-41)50-40/h25-26,28,33-38,40-46H,2-24,27,29-31H2,1H3,(H,47,48)/b28-25+,32-26-/t33-,34+,35-,36-,37+,38-,40-/m0/s1 |
| InChIKey | UJPWQNSWFSMAKJ-HJPACQKESA-N |
| Literature Reference Author | B.B.MESSANGA,S.F.KIMBU,B.L.SONDENGAM,B.BODO |
| Literature Reference Citation | FITOTERAPIA,72,732(2001) |
| Literature Reference DOI | 10.1016/S0367-326X(01)00286-6 |
| Molecular Weight | 715.022 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN4076 |