| SpectraBase Compound ID | 9lud2vrrcR9 |
|---|---|
| InChI | InChI=1S/C40H77NO10/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-28-35(45)41-32(30-50-40-39(49)38(48)37(47)34(29-42)51-40)36(46)33(44)27-23-19-17-18-22-26-31(43)25-21-8-6-4-2/h11-12,31-34,36-40,42-44,46-49H,3-10,13-30H2,1-2H3,(H,41,45)/b12-11+/t31?,32?,33?,34-,36?,37-,38+,39-,40-/m0/s1 |
| InChIKey | KNARYUCFPVYOGC-VTHWRFOVSA-N |
| Mol Weight | 732.1 g/mol |
| Molecular Formula | C40H77NO10 |
| Exact Mass | 731.554748 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AjHoN562Cd6 |
|---|---|
| Name | BONAROSIDE;1,3,4,12-TETRAHYDROXY-2-(9-HEXADECENOYLAMINO)-OCTADECANE-1-O-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H77NO10 |
| InChI | InChI=1S/C40H77NO10/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-28-35(45)41-32(30-50-40-39(49)38(48)37(47)34(29-42)51-40)36(46)33(44)27-23-19-17-18-22-26-31(43)25-21-8-6-4-2/h11-12,31-34,36-40,42-44,46-49H,3-10,13-30H2,1-2H3,(H,41,45)/b12-11+/t31?,32?,33?,34-,36?,37-,38+,39-,40-/m0/s1 |
| InChIKey | KNARYUCFPVYOGC-VTHWRFOVSA-N |
| Literature Reference Author | L.D.KONG,Z.ABLIZ,L.J.LI,C.H.K.CHENG,R.X.TAN |
| Literature Reference Citation | PHYTOCHEM.,58,645(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00176-5 |
| Molecular Weight | 732.052 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU2964 |