| SpectraBase Compound ID | 4Zn8zPM3VXc |
|---|---|
| InChI | InChI=1S/C40H61N3O19/c1-32(2)48-14-17(54-32)20-38(41,23-26(51-20)60-35(7,8)57-23)29(44)42-39(21(18-15-49-33(3,4)55-18)52-27-24(39)58-36(9,10)61-27)30(45)43-40(31(46)47-13)22(19-16-50-34(5,6)56-19)53-28-25(40)59-37(11,12)62-28/h17-28H,14-16,41H2,1-13H3,(H,42,44)(H,43,45)/t17?,18?,19?,20-,21-,22-,23+,24+,25+,26-,27-,28-,38+,39+,40+/m1/s1 |
| InChIKey | NFIWMBFUXDPAEP-DEDHBQRHSA-N |
| Mol Weight | 887.9 g/mol |
| Molecular Formula | C40H61N3O19 |
| Exact Mass | 887.389927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DZJuHrP7XTu |
|---|---|
| Name | NFIWMBFUXDPAEP-DEDHBQRHSA-N |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H61N3O19 |
| InChI | InChI=1S/C40H61N3O19/c1-32(2)48-14-17(54-32)20-38(41,23-26(51-20)60-35(7,8)57-23)29(44)42-39(21(18-15-49-33(3,4)55-18)52-27-24(39)58-36(9,10)61-27)30(45)43-40(31(46)47-13)22(19-16-50-34(5,6)56-19)53-28-25(40)59-37(11,12)62-28/h17-28H,14-16,41H2,1-13H3,(H,42,44)(H,43,45)/t17?,18?,19?,20-,21-,22-,23+,24+,25+,26-,27-,28-,38+,39+,40+/m1/s1 |
| InChIKey | NFIWMBFUXDPAEP-DEDHBQRHSA-N |
| Literature Reference Author | A.SCAFFIDI,B.W.SKELTON,R.V.STICK,A.H.WHITE |
| Literature Reference Citation | AUSTR.J.CHEM.,57,733(2004) |
| Literature Reference DOI | 10.1071/CH04014 |
| Molecular Weight | 887.933 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN20015 |