| SpectraBase Compound ID | Ep2GE6U29ec |
|---|---|
| InChI | InChI=1S/C55H76N4O16/c1-32-36(71-49(67)44(64)42(34-19-11-9-12-20-34)59-50(68)75-51(3,4)5)30-55(69)47(73-48(66)35-21-13-10-14-22-35)45-53(8,46(65)43(63)41(32)52(55,6)7)37(29-38-54(45,31-70-38)74-33(2)60)72-40(62)24-17-23-39(61)58-28-16-15-26-57-27-18-25-56/h9-14,19-22,36-38,42-45,47,57,63-64,69H,15-18,23-31,56H2,1-8H3,(H,58,61)(H,59,68)/t36-,37-,38+,42-,43+,44+,45-,47-,53+,54-,55+/m0/s1 |
| InChIKey | KORGZBCOKUYMQD-HEGIZMMDSA-N |
| Mol Weight | 1049.2 g/mol |
| Molecular Formula | C55H76N4O16 |
| Exact Mass | 1048.525632 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | I9bdF2L3NAJ |
|---|---|
| Name | KORGZBCOKUYMQD-HEGIZMMDSA-N |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H76N4O16 |
| InChI | InChI=1S/C55H76N4O16/c1-32-36(71-49(67)44(64)42(34-19-11-9-12-20-34)59-50(68)75-51(3,4)5)30-55(69)47(73-48(66)35-21-13-10-14-22-35)45-53(8,46(65)43(63)41(32)52(55,6)7)37(29-38-54(45,31-70-38)74-33(2)60)72-40(62)24-17-23-39(61)58-28-16-15-26-57-27-18-25-56/h9-14,19-22,36-38,42-45,47,57,63-64,69H,15-18,23-31,56H2,1-8H3,(H,58,61)(H,59,68)/t36-,37-,38+,42-,43+,44+,45-,47-,53+,54-,55+/m0/s1 |
| InChIKey | KORGZBCOKUYMQD-HEGIZMMDSA-N |
| Literature Reference Author | D.GUENARD,S.THORET,J.DUBOIS,M.T.ADELINE,Q.WANG,F.GUERITTE |
| Literature Reference Citation | BIOORG.MED.CHEM.,8,145(2000) |
| Literature Reference DOI | 10.1016/S0968-0896(99)00279-5 |
| Molecular Weight | 1049.226 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN20078 |