| SpectraBase Compound ID | 2Iza4ch7V7F |
|---|---|
| InChI | InChI=1S/C26H38O6/c1-14(2)8-10-23(5)20(28)18(19(27)15(3)4)21(29)26(22(23)30)12-17-16(25(7,32)13-26)9-11-24(17,6)31/h8,15-17,28,31-32H,9-13H2,1-7H3/t16-,17+,23+,24-,25-,26+/m1/s1 |
| InChIKey | PIDFRBSCCDEYLQ-YQPSMSEZSA-N |
| Mol Weight | 446.6 g/mol |
| Molecular Formula | C26H38O6 |
| Exact Mass | 446.266839 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8aqm31znyY4 |
|---|---|
| Name | CHIPERICUMIN_C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H38O6 |
| InChI | InChI=1S/C26H38O6/c1-14(2)8-10-23(5)20(28)18(19(27)15(3)4)21(29)26(22(23)30)12-17-16(25(7,32)13-26)9-11-24(17,6)31/h8,15-17,28,31-32H,9-13H2,1-7H3/t16-,17+,23+,24-,25-,26+/m1/s1 |
| InChIKey | PIDFRBSCCDEYLQ-YQPSMSEZSA-N |
| Literature Reference Author | S.ABE,N.TANAKA,J.KOBAYASHI |
| Literature Reference Citation | J.NAT.PROD.,75,484(2012) |
| Literature Reference DOI | 10.1021/np200741x |
| Molecular Weight | 446.584 g/mol |
| Sample ID | 40199 |
| Solvent | CDCl3 |