| SpectraBase Compound ID | 1zYF1hJO4pC |
|---|---|
| InChI | InChI=1S/C71H74N2O18/c1-2-36-82-68-55(72-64(76)48-30-16-17-31-49(48)65(72)77)62(83-39-46-26-12-5-13-27-46)60(52(86-68)41-80-37-44-22-8-3-9-23-44)89-69-56(73-66(78)50-32-18-19-33-51(50)67(73)79)63(84-40-47-28-14-6-15-29-47)61(53(87-69)42-81-38-45-24-10-4-11-25-45)90-70-58(75)57(74)59-54(88-70)43-85-71(91-59)34-20-7-21-35-71/h2-6,8-19,22-33,52-63,68-70,74-75H,1,7,20-21,34-43H2/t52-,53+,54-,55-,56+,57-,58+,59-,60-,61+,62-,63+,68-,69-,70+/m0/s1 |
| InChIKey | RPKFWPHFILHYEP-MDBYGGKOSA-N |
| Mol Weight | 1243.4 g/mol |
| Molecular Formula | C71H74N2O18 |
| Exact Mass | 1242.493664 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 | D6PJM5Ec7dS |
|---|---|
| Name | RPKFWPHFILHYEP-MDBYGGKOSA-N |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H74N2O18 |
| InChI | InChI=1S/C71H74N2O18/c1-2-36-82-68-55(72-64(76)48-30-16-17-31-49(48)65(72)77)62(83-39-46-26-12-5-13-27-46)60(52(86-68)41-80-37-44-22-8-3-9-23-44)89-69-56(73-66(78)50-32-18-19-33-51(50)67(73)79)63(84-40-47-28-14-6-15-29-47)61(53(87-69)42-81-38-45-24-10-4-11-25-45)90-70-58(75)57(74)59-54(88-70)43-85-71(91-59)34-20-7-21-35-71/h2-6,8-19,22-33,52-63,68-70,74-75H,1,7,20-21,34-43H2/t52-,53+,54-,55-,56+,57-,58+,59-,60-,61+,62-,63+,68-,69-,70+/m0/s1 |
| InChIKey | RPKFWPHFILHYEP-MDBYGGKOSA-N |
| Literature Reference Author | I.MATSUO,M.WADA,S.MANABE,Y.YAMAGUCHI,K.OTAKE,K.KATO,Y.ITO |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,3402(2003) |
| Literature Reference DOI | 10.1021/ja021288q |
| Molecular Weight | 1243.371 g/mol |
| Sample ID | 30287 |
| Solvent | CDCl3 |