| SpectraBase Compound ID | KZSgQr8LYLb |
|---|---|
| InChI | InChI=1S/C46H68O14/c1-27-13-15-33-43(3)17-11-19-45(33,5)31(27)23-57-37(41(51)55-9)29(21-35(47)53-7)39(49)60-26-44(4)18-12-20-46(6)32(28(2)14-16-34(44)46)24-58-38(42(52)56-10)30(22-36(48)54-8)40(50)59-25-43/h29-34,37-38H,1-2,11-26H2,3-10H3/t29-,30-,31-,32+,33?,34?,37-,38-,43+,44-,45+,46-/m0/s1 |
| InChIKey | RHKNNHFEYPGZAP-QLSZHFEJSA-N |
| Mol Weight | 845.0 g/mol |
| Molecular Formula | C46H68O14 |
| Exact Mass | 844.460907 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 | CPMjpcOrJqH |
|---|---|
| Name | CRYPTOPORIC-ACID-D-TETRAMETHYLESTER;CA-D-TETRAMETHYLESTER |
| Compound Number | 23 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H68O14 |
| InChI | InChI=1S/C46H68O14/c1-27-13-15-33-43(3)17-11-19-45(33,5)31(27)23-57-37(41(51)55-9)29(21-35(47)53-7)39(49)60-26-44(4)18-12-20-46(6)32(28(2)14-16-34(44)46)24-58-38(42(52)56-10)30(22-36(48)54-8)40(50)59-25-43/h29-34,37-38H,1-2,11-26H2,3-10H3/t29-,30-,31-,32+,33?,34?,37-,38-,43+,44-,45+,46-/m0/s1 |
| InChIKey | RHKNNHFEYPGZAP-QLSZHFEJSA-N |
| Literature Reference Author | Y.ASAKAWA,T.HASHIMOTO,Y.MIZUNO,M.TORI,Y.FUKAZAWA |
| Literature Reference Citation | PHYTOCHEM.,31,579(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)90042-O |
| Molecular Weight | 845.038 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU6110 |