| SpectraBase Compound ID | 1WLOaD1rFor |
|---|---|
| InChI | InChI=1S/C21H18O8/c1-25-15-8-10(3-4-14(15)22)7-12-17-21(29-19(12)24)6-5-11-13(18(23)26-2)9-27-20(28-17)16(11)21/h3-9,11,16-17,20,22H,1-2H3/b12-7-/t11?,16?,17?,20-,21+/m1/s1 |
| InChIKey | TXGZCLZZWWAVDP-NMLSKNCTSA-N |
| Mol Weight | 398.37 g/mol |
| Molecular Formula | C21H18O8 |
| Exact Mass | 398.100168 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4AWTjkqONik |
|---|---|
| Name | ORUWACIN |
| Compound Number | 41 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H18O8 |
| InChI | InChI=1S/C21H18O8/c1-25-15-8-10(3-4-14(15)22)7-12-17-21(29-19(12)24)6-5-11-13(18(23)26-2)9-27-20(28-17)16(11)21/h3-9,11,16-17,20,22H,1-2H3/b12-7-/t11?,16?,17?,20-,21+/m1/s1 |
| InChIKey | TXGZCLZZWWAVDP-NMLSKNCTSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,54,1173(1991) |
| Literature Reference DOI | 10.1021/np50077a001 |
| Molecular Weight | 398.369 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS4421 |