AC1L8UXQ
4,5,13,17-tetrahydroxy-6,14,18-trimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadeca-7,14-diene-9,16-dione
Also Known As: CHAPARRINONE,15-DEHYDRO-|5-Hydroxy-.DELTA.14,15-chaparrinone|CHAPARRINONE,5-HYDROXY-14,15-DEHYDRO-|1,5,11,12-Tetrahydroxy-11,20-epoxypicrasa-3,14-diene-2,16-dione|4,5,13,17-Tetrahydroxy-6,14,18-trimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadeca-7,14-diene-9,16-dione
| Molecular Formula | C20H24O8 |
|---|---|
| Molecular Weight | 392.14713 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 392.14713 |
| Monoisotopic Mass | 392.14713 |
| Heavy Atoms | 28 |
| Complexity | 877.0 |
Chemical Identifiers
| CAS Number | 79752-57-1 |
|---|---|
| SMILES | CC1C(C2(C3C4(C(C(=O)C=C(C4(CC5C3(C1=CC(=O)O5)CO2)O)C)O)C)O)O |
| InChIKey | SMBOOGQNSAWYCA-UHFFFAOYSA-N |
Product Overview
AC1L8UXQ (CAS 79752-57-1), with molecular formula C20H24O8 and molecular weight 392.14713 g/mol. IUPAC: 4,5,13,17-tetrahydroxy-6,14,18-trimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadeca-7,14-diene-9,16-dione.
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