| SpectraBase Compound ID | 2Nh7LDRsWej |
|---|---|
| InChI | InChI=1S/C45H68O14/c1-26-13-15-32-42(3,4)17-11-19-44(32,6)30(26)23-58-37(41(53)56-10)29(22-35(48)49)39(51)59-25-43(5)18-12-20-45(7)31(27(2)14-16-33(43)45)24-57-36(40(52)55-9)28(21-34(46)47)38(50)54-8/h28-33,36-37H,1-2,11-25H2,3-10H3,(H,46,47)(H,48,49)/t28-,29+,30+,31+,32?,33?,36+,37+,43+,44-,45-/m0/s1 |
| InChIKey | CWMFUDUBPHDHAX-PCQDIATISA-N |
| Mol Weight | 833.0 g/mol |
| Molecular Formula | C45H68O14 |
| Exact Mass | 832.460907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4v8TUGR7W3r |
|---|---|
| Name | CRYPTOPORIC-ACID-C;CA-C |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H68O14 |
| InChI | InChI=1S/C45H68O14/c1-26-13-15-32-42(3,4)17-11-19-44(32,6)30(26)23-58-37(41(53)56-10)29(22-35(48)49)39(51)59-25-43(5)18-12-20-45(7)31(27(2)14-16-33(43)45)24-57-36(40(52)55-9)28(21-34(46)47)38(50)54-8/h28-33,36-37H,1-2,11-25H2,3-10H3,(H,46,47)(H,48,49)/t28-,29+,30+,31+,32?,33?,36+,37+,43+,44-,45-/m0/s1 |
| InChIKey | CWMFUDUBPHDHAX-PCQDIATISA-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 | 833.027 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU6107 |