| SpectraBase Compound ID | D7cOC6eLOHt |
|---|---|
| InChI | InChI=1S/C49H53N5O7/c1-48(2,34-61-49(35-14-6-5-7-15-35,36-19-23-38(58-3)24-20-36)37-21-25-39(59-4)26-22-37)46(56)47(57)53-30-13-29-52-45(55)18-12-31-60-40-32-43(41-16-8-10-27-50-41)54-44(33-40)42-17-9-11-28-51-42/h5-11,14-17,19-28,32-33,46,56H,12-13,18,29-31,34H2,1-4H3,(H,52,55)(H,53,57)/t46-/m1/s1 |
| InChIKey | HFBIWJAVBXZNDT-YACUFSJGSA-N |
| Mol Weight | 824.0 g/mol |
| Molecular Formula | C49H53N5O7 |
| Exact Mass | 823.394499 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AKycRkzOuYX |
|---|---|
| Name | HFBIWJAVBXZNDT-YACUFSJGSA-N |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H53N5O7 |
| InChI | InChI=1S/C49H53N5O7/c1-48(2,34-61-49(35-14-6-5-7-15-35,36-19-23-38(58-3)24-20-36)37-21-25-39(59-4)26-22-37)46(56)47(57)53-30-13-29-52-45(55)18-12-31-60-40-32-43(41-16-8-10-27-50-41)54-44(33-40)42-17-9-11-28-51-42/h5-11,14-17,19-28,32-33,46,56H,12-13,18,29-31,34H2,1-4H3,(H,52,55)(H,53,57)/t46-/m1/s1 |
| InChIKey | HFBIWJAVBXZNDT-YACUFSJGSA-N |
| Literature Reference Author | F.FREVILLE,N.PIERRE,S.MOREAU |
| Literature Reference Citation | CAN.J.CHEM.,84,854(2006) |
| Literature Reference DOI | 10.1139/v06-080 |
| Molecular Weight | 823.989 g/mol |
| Sample ID | 46740 |
| Solvent | CDCl3 |