| SpectraBase Compound ID | 1FYQDmkEFqJ |
|---|---|
| InChI | InChI=1S/C38H36O16/c1-51-27-15-19(5-9-23(27)41)31-33(37(49)53-29(35(45)46)13-17-3-7-21(39)25(43)11-17)32(20-6-10-24(42)28(16-20)52-2)34(31)38(50)54-30(36(47)48)14-18-4-8-22(40)26(44)12-18/h3-12,15-16,29-34,39-44H,13-14H2,1-2H3,(H,45,46)(H,47,48)/t29-,30+,31+,32+,33-,34- |
| InChIKey | MLLCKVCQTUPSAM-SYNRPDFZSA-N |
| Mol Weight | 748.7 g/mol |
| Molecular Formula | C38H36O16 |
| Exact Mass | 748.200335 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E4zwGnH1iBy |
|---|---|
| Name | SHIMOBASHIRIC-ACID-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H36O16 |
| InChI | InChI=1S/C38H36O16/c1-51-27-15-19(5-9-23(27)41)31-33(37(49)53-29(35(45)46)13-17-3-7-21(39)25(43)11-17)32(20-6-10-24(42)28(16-20)52-2)34(31)38(50)54-30(36(47)48)14-18-4-8-22(40)26(44)12-18/h3-12,15-16,29-34,39-44H,13-14H2,1-2H3,(H,45,46)(H,47,48)/t29-,30+,31+,32+,33-,34- |
| InChIKey | MLLCKVCQTUPSAM-SYNRPDFZSA-N |
| Literature Reference Author | T.MURATA,T.MIYASE,F.YOSHIZAKI |
| Literature Reference Citation | CHEM.PHARM.BULL.,60,121(2012) |
| Literature Reference DOI | 10.1248/cpb.60.121 |
| Molecular Weight | 748.694 g/mol |
| Source File Reference | UWBT4218 |