| SpectraBase Compound ID | Dyfuf4sIj8r |
|---|---|
| InChI | InChI=1S/C27H26N3O6PS2.C9H16N2/c1-20(31)28-23-10-14-25(15-11-23)36-37(38,39)35-18-17-29(2)24-12-7-21(8-13-24)5-3-4-6-22-9-16-26(30(33)34)27(32)19-22;1-2-5-9-10-6-4-8-11(9)7-3-1/h4,6-16,19,32H,17-18H2,1-2H3,(H,28,31)(H,38,39);1-8H2/b6-4+; |
| InChIKey | BCBRRNWGJPZJEZ-CVDVRWGVSA-N |
| Mol Weight | 735.85 g/mol |
| Molecular Formula | C36H42N5O6PS2 |
| Exact Mass | 735.231413 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ba1jzButplh |
|---|---|
| Name | BCBRRNWGJPZJEZ-CVDVRWGVSA-N |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H42N5O6PS2 |
| InChI | InChI=1S/C27H26N3O6PS2.C9H16N2/c1-20(31)28-23-10-14-25(15-11-23)36-37(38,39)35-18-17-29(2)24-12-7-21(8-13-24)5-3-4-6-22-9-16-26(30(33)34)27(32)19-22;1-2-5-9-10-6-4-8-11(9)7-3-1/h4,6-16,19,32H,17-18H2,1-2H3,(H,28,31)(H,38,39);1-8H2/b6-4+; |
| InChIKey | BCBRRNWGJPZJEZ-CVDVRWGVSA-N |
| Literature Reference Author | O.BRUEMMER,J.J.L.CLAIR,K.D.JANDA |
| Literature Reference Citation | ORG.LETTERS,1,415(1999) |
| Literature Reference DOI | 10.1021/ol990730f |
| Solvent | CDCl3:CD3OD |
| Source File Reference | UWSI26358 |