| SpectraBase Compound ID | 9Si1rzdIKK4 |
|---|---|
| InChI | InChI=1S/C34H30O7/c35-27(15-14-22-8-3-1-4-9-22)32-29(37)20-28(36)31-24-18-26(19-25-12-7-13-30(38)39-25)40-34(21-24,41-33(31)32)17-16-23-10-5-2-6-11-23/h1-11,13-17,20,24-26,36-37H,12,18-19,21H2/b15-14+,17-16+/t24-,25+,26-,34-/m0/s1 |
| InChIKey | PRJFEGMPMYRWIX-MXIXYQCPSA-N |
| Mol Weight | 550.6 g/mol |
| Molecular Formula | C34H30O7 |
| Exact Mass | 550.199153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Xb5eWkU2IJ |
|---|---|
| Name | OBOCHALCOLACTONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H30O7 |
| InChI | InChI=1S/C34H30O7/c35-27(15-14-22-8-3-1-4-9-22)32-29(37)20-28(36)31-24-18-26(19-25-12-7-13-30(38)39-25)40-34(21-24,41-33(31)32)17-16-23-10-5-2-6-11-23/h1-11,13-17,20,24-26,36-37H,12,18-19,21H2/b15-14+,17-16+/t24-,25+,26-,34-/m0/s1 |
| InChIKey | PRJFEGMPMYRWIX-MXIXYQCPSA-N |
| Literature Reference Author | V.DUMONTET,N.V.HUNG,M.T.ADELINE,C.RICHE,A.CHIARONI,T.SEVENET ,F.GUERITTE |
| Literature Reference Citation | J.NAT.PROD.,67,858(2004) |
| Literature Reference DOI | 10.1021/np030510h |
| Molecular Weight | 550.608 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ5625 |