| SpectraBase Compound ID | 3KlKj3swhWP |
|---|---|
| InChI | InChI=1S/C41H45N5O11/c1-25-21-46(40(50)44-38(25)48)36-19-31(47)33(56-36)22-53-24-54-32-20-37(45-18-17-35(42)43-39(45)49)57-34(32)23-55-41(26-7-5-4-6-8-26,27-9-13-29(51-2)14-10-27)28-11-15-30(52-3)16-12-28/h4-18,21,31-34,36-37,47H,19-20,22-24H2,1-3H3,(H2,42,43,49)(H,44,48,50)/t31-,32+,33+,34-,36+,37-/m0/s1 |
| InChIKey | HNBOTFTXLBKNBA-YZFSMBDVSA-N |
| Mol Weight | 783.8 g/mol |
| Molecular Formula | C41H45N5O11 |
| Exact Mass | 783.311557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IOkKYcYxOKD |
|---|---|
| Name | HNBOTFTXLBKNBA-YZFSMBDVSA-N |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H45N5O11 |
| InChI | InChI=1S/C41H45N5O11/c1-25-21-46(40(50)44-38(25)48)36-19-31(47)33(56-36)22-53-24-54-32-20-37(45-18-17-35(42)43-39(45)49)57-34(32)23-55-41(26-7-5-4-6-8-26,27-9-13-29(51-2)14-10-27)28-11-15-30(52-3)16-12-28/h4-18,21,31-34,36-37,47H,19-20,22-24H2,1-3H3,(H2,42,43,49)(H,44,48,50)/t31-,32+,33+,34-,36+,37-/m0/s1 |
| InChIKey | HNBOTFTXLBKNBA-YZFSMBDVSA-N |
| Literature Reference Author | P.J.M.L.QUAEDFLIEG,G.A.VANDERMAREL,E.KUYL-YEHESKIELY,J.H.VAN BOOM |
| Literature Reference Citation | REC.TR.CH.P.-B.,110,435(1991) |
| Literature Reference DOI | 10.1002/recl.19911101008 |
| Molecular Weight | 783.835 g/mol |
| Solvent | Unknown |
| Source File Reference | UWTS2376 |