| SpectraBase Compound ID | EMZpa2gf3BC |
|---|---|
| InChI | InChI=1S/C41H46N4O5/c1-6-23-21-43-16-14-38-27-10-8-9-11-30(27)45-35(37(47)49-5)26(23)18-33(43)41(38,45)50-32-20-28-31(19-29(32)38)42(3)40-13-12-25-24(7-2)22-44(40)17-15-39(28,40)34(25)36(46)48-4/h6-11,19-20,25-26,33-35H,12-18,21-22H2,1-5H3/b23-6+,24-7+/t25-,26?,33-,34-,35-,38+,39-,40-,41-/m0/s1 |
| InChIKey | MZJVUGUEYOIDJD-WAWUVBCKSA-N |
| Mol Weight | 674.8 g/mol |
| Molecular Formula | C41H46N4O5 |
| Exact Mass | 674.346821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | xcM1t2DEdb |
|---|---|
| Name | PLEIOCORIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H46N4O5 |
| InChI | InChI=1S/C41H46N4O5/c1-6-23-21-43-16-14-38-27-10-8-9-11-30(27)45-35(37(47)49-5)26(23)18-33(43)41(38,45)50-32-20-28-31(19-29(32)38)42(3)40-13-12-25-24(7-2)22-44(40)17-15-39(28,40)34(25)36(46)48-4/h6-11,19-20,25-26,33-35H,12-18,21-22H2,1-5H3/b23-6+,24-7+/t25-,26?,33-,34-,35-,38+,39-,40-,41-/m0/s1 |
| InChIKey | MZJVUGUEYOIDJD-WAWUVBCKSA-N |
| Literature Reference Author | B.C.DAS,J.P.COSSON,G.LUKACS,P.POTIER |
| Literature Reference Citation | TETRAH.LETT.,15,4299(1974) |
| Literature Reference DOI | 10.1016/S0040-4039(01)92147-1 |
| Molecular Weight | 674.840 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW12757 |