| SpectraBase Compound ID | 48fFXqh8x98 |
|---|---|
| InChI | InChI=1S/C42H57NO14/c1-21-30(48)18-27-17-29-28(20-52-22(2)44)31(56-38(50)35(49)34(26-15-13-12-14-16-26)43-39(51)57-40(6,7)8)19-32(53-23(3)45)42(29,11)37(55-25(5)47)36(54-24(4)46)33(21)41(27,9)10/h12-16,21,27,31-37,49H,17-20H2,1-11H3,(H,43,51)/t21-,27-,31+,32+,33-,34-,35+,36-,37+,42+/m1/s1 |
| InChIKey | AWIZIQFPOHSWIQ-AELUDZEASA-N |
| Mol Weight | 799.9 g/mol |
| Molecular Formula | C42H57NO14 |
| Exact Mass | 799.377906 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5g066H3b1gy |
|---|---|
| Name | AWIZIQFPOHSWIQ-AELUDZEASA-N |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H57NO14 |
| InChI | InChI=1S/C42H57NO14/c1-21-30(48)18-27-17-29-28(20-52-22(2)44)31(56-38(50)35(49)34(26-15-13-12-14-16-26)43-39(51)57-40(6,7)8)19-32(53-23(3)45)42(29,11)37(55-25(5)47)36(54-24(4)46)33(21)41(27,9)10/h12-16,21,27,31-37,49H,17-20H2,1-11H3,(H,43,51)/t21-,27-,31+,32+,33-,34-,35+,36-,37+,42+/m1/s1 |
| InChIKey | AWIZIQFPOHSWIQ-AELUDZEASA-N |
| Literature Reference Author | A.NIKOLAKAKIS,J.H.WU,G.BATIST,F.SAURIOL,O.MAMER,L.O.ZAMIR |
| Literature Reference Citation | BIOORG.MED.CHEM.,10,2387(2002) |
| Literature Reference DOI | 10.1016/S0968-0896(02)00066-4 |
| Molecular Weight | 799.913 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN28591 |