| SpectraBase Compound ID | 34flVuJmzgn |
|---|---|
| InChI | InChI=1S/C47H72O15/c1-28-14-16-34-44(3,26-48)18-12-20-46(34,5)32(28)24-61-39(43(54)59-11)31(23-37(50)56-8)41(52)62-27-45(4)19-13-21-47(6)33(29(2)15-17-35(45)47)25-60-38(42(53)58-10)30(40(51)57-9)22-36(49)55-7/h30-35,38-39,48H,1-2,12-27H2,3-11H3/t30-,31+,32+,33+,34?,35?,38+,39+,44+,45+,46-,47-/m0/s1 |
| InChIKey | ASGYFNXWNVZWJO-UBDLOJBGSA-N |
| Mol Weight | 877.1 g/mol |
| Molecular Formula | C47H72O15 |
| Exact Mass | 876.487122 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GlZkYu8IDhA |
|---|---|
| Name | CRYPTOPORIC-ACID-E-PENTAMETHYLESTER;CA-E-PENTAMETHYLESTER |
| Compound Number | 27 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H72O15 |
| InChI | InChI=1S/C47H72O15/c1-28-14-16-34-44(3,26-48)18-12-20-46(34,5)32(28)24-61-39(43(54)59-11)31(23-37(50)56-8)41(52)62-27-45(4)19-13-21-47(6)33(29(2)15-17-35(45)47)25-60-38(42(53)58-10)30(40(51)57-9)22-36(49)55-7/h30-35,38-39,48H,1-2,12-27H2,3-11H3/t30-,31+,32+,33+,34?,35?,38+,39+,44+,45+,46-,47-/m0/s1 |
| InChIKey | ASGYFNXWNVZWJO-UBDLOJBGSA-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 | 877.080 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU6112 |