Hainanolide
(11S,12R,13S,19R)-8,19-dimethyl-14,17-dioxahexacyclo[13.3.1.01,11.04,10.09,13.012,16]nonadeca-4,7,9-triene-6,18-dione
Also Known As: Hainanolide|Harringtonolide|KST-1A7934|(11s,12r,13s,19r)-8,19-dimethyl-14,17-dioxahexacyclo[13.3.1.01,11.04,10.09,13.012,16]nonadeca-4,7,9-triene-6,18-dione|(4aS,10bS,10cR,11R)-5,11-Dimethyl-2a,4a,9,10,10b,10c-hexahydro-1H-3,10a-methano-2,4-dioxacyclohepta[bc]cyclopenta[jk]acenaphthylene-1,7(3H)-dione|1H-3,10a-Methano-2,4-dioxacyclohepta[bc]cyclopent[jk]acenaphthylene-1,7(4aH)-dione,2a,3,9,10,10b,10c-hexahydro-5,11-dimethyl-, (2aR,3R,4aR,10aS,10bS,10cR,11S)-|5,11-Dimethyl-2a,4a,9,10,10b,10c-hexahydro-1H-3,10a-methano-2,4-dioxacyclohepta[bc]cyclopenta[jk]acenaphthylene-1,7(3H)-dione
| Molecular Formula | C19H18O4 |
|---|---|
| Molecular Weight | 310.1205 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 310.1205 |
| Monoisotopic Mass | 310.1205 |
| Heavy Atoms | 23 |
| Complexity | 800.0 |
Chemical Identifiers
| CAS Number | 7325-41-9 |
|---|---|
| SMILES | C[C@H]1C2C3[C@@H]4[C@@H]5C1(CCC6=CC(=O)C=C(C(=C56)[C@H]4O2)C)C(=O)O3 |
| InChIKey | QNJIIOHVULPMRL-OFSDVKARSA-N |
Product Overview
Hainanolide (CAS 7325-41-9), with molecular formula C19H18O4 and molecular weight 310.1205 g/mol. IUPAC: (11S,12R,13S,19R)-8,19-dimethyl-14,17-dioxahexacyclo[13.3.1.01,11.04,10.09,13.012,16]nonadeca-4,7,9-triene-6,18-dione.