| SpectraBase Compound ID | KPbHo7ygAZM |
|---|---|
| InChI | InChI=1S/C40H42O14/c1-49-31-13-21(5-7-29(31)41)17-39(47)25(19-53-37(39)45)9-23-11-27(35(43)33(15-23)51-3)28-12-24(16-34(52-4)36(28)44)10-26-20-54-38(46)40(26,48)18-22-6-8-30(42)32(14-22)50-2/h5-8,11-16,25-26,41-44,47-48H,9-10,17-20H2,1-4H3/t25-,26-,39-,40-/m1/s1 |
| InChIKey | UFFFFORCHIKZSY-CQYVORAFSA-N |
| Mol Weight | 746.8 g/mol |
| Molecular Formula | C40H42O14 |
| Exact Mass | 746.257456 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5CcXeTfOFR8 |
|---|---|
| Name | BIS-5,5-NORTRACHELOGENIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H42O14 |
| InChI | InChI=1S/C40H42O14/c1-49-31-13-21(5-7-29(31)41)17-39(47)25(19-53-37(39)45)9-23-11-27(35(43)33(15-23)51-3)28-12-24(16-34(52-4)36(28)44)10-26-20-54-38(46)40(26,48)18-22-6-8-30(42)32(14-22)50-2/h5-8,11-16,25-26,41-44,47-48H,9-10,17-20H2,1-4H3/t25-,26-,39-,40-/m1/s1 |
| InChIKey | UFFFFORCHIKZSY-CQYVORAFSA-N |
| Literature Reference Author | L.Y.WANG,N.UNEHARA,S.KITANAKA |
| Literature Reference Citation | CHEM.PHARM.BULL.,53,1348(2005) |
| Literature Reference DOI | 10.1248/cpb.53.1348 |
| Molecular Weight | 746.765 g/mol |
| Sample ID | 33204 |
| Solvent | CD3OD |