| SpectraBase Compound ID | 6FNpWb7AMow |
|---|---|
| InChI | InChI=1S/C39H38N4O8P.C6H15N/c1-47-30-17-13-28(14-18-30)39(27-11-7-4-8-12-27,29-15-19-31(48-2)20-16-29)49-24-34-33(51-52(45)46)23-35(50-34)43-25-41-36-32(21-22-40-37(36)43)42-38(44)26-9-5-3-6-10-26;1-4-7(5-2)6-3/h3-22,25,33-35H,23-24,52H2,1-2H3,(H,45,46)(H,40,42,44);4-6H2,1-3H3/q-1;/p+1/t33-,34+,35+;/m1./s1 |
| InChIKey | WSPFQRSIUXESOH-ULNIAXGWSA-O |
| Mol Weight | 822.9 g/mol |
| Molecular Formula | C45H53N5O8P |
| Exact Mass | 822.363176 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bhzk0DGW1NY |
|---|---|
| Name | WSPFQRSIUXESOH-ULNIAXGWSA-O |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H52N5O8P |
| InChI | InChI=1S/C39H38N4O8P.C6H15N/c1-47-30-17-13-28(14-18-30)39(27-11-7-4-8-12-27,29-15-19-31(48-2)20-16-29)49-24-34-33(51-52(45)46)23-35(50-34)43-25-41-36-32(21-22-40-37(36)43)42-38(44)26-9-5-3-6-10-26;1-4-7(5-2)6-3/h3-22,25,33-35H,23-24,52H2,1-2H3,(H,45,46)(H,40,42,44);4-6H2,1-3H3/q-1;/p+1/t33-,34+,35+;/m1./s1 |
| InChIKey | WSPFQRSIUXESOH-ULNIAXGWSA-O |
| Literature Reference Author | F.SEELA,T.WENZEL |
| Literature Reference Citation | HETEROCYCLES,36,237(1993) |
| Literature Reference DOI | 10.3987/COM-92-6214 |
| Molecular Weight | 821.910 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCP7659 |