| SpectraBase Compound ID | A7rxaU2GGhj |
|---|---|
| InChI | InChI=1S/C30H30O14/c31-12-19-23(37)25(39)26(40)29(44-19)30(43)27(41)21(17(11-20(35)36)14-4-8-16(33)9-5-14)24(38)22(28(30)42)18(34)10-3-13-1-6-15(32)7-2-13/h1-10,17,19,23,25-26,29,31-33,37,39-43H,11-12H2,(H,35,36)/b10-3+/t17-,19-,23-,25+,26-,29+,30?/m0/s1 |
| InChIKey | CYCRWWWXHMLPHW-VPRXLANHSA-N |
| Mol Weight | 614.56 g/mol |
| Molecular Formula | C30H30O14 |
| Exact Mass | 614.163556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 61oLO6jomzi |
|---|---|
| Name | SAFFLOMIN-C;1-ENOL-3,7-DIKETO-FORM;REFERENCE-32 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H30O14 |
| InChI | InChI=1S/C30H30O14/c31-12-19-23(37)25(39)26(40)29(44-19)30(43)27(41)21(17(11-20(35)36)14-4-8-16(33)9-5-14)24(38)22(28(30)42)18(34)10-3-13-1-6-15(32)7-2-13/h1-10,17,19,23,25-26,29,31-33,37,39-43H,11-12H2,(H,35,36)/b10-3+/t17-,19-,23-,25+,26-,29+,30?/m0/s1 |
| InChIKey | CYCRWWWXHMLPHW-VPRXLANHSA-N |
| Literature Reference Author | S.YUE,Y.TANG,S.LI,J.A.DUAN |
| Literature Reference Citation | MOLECULES,18,15220(2013) |
| Literature Reference DOI | 10.3390/molecules181215220 |
| Molecular Weight | 614.560 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWIR9969 |