Isoneorautenol
7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14(19),15,17-heptaen-17-ol
| Molecular Formula | C20H18O4 |
|---|---|
| Molecular Weight | 322.4 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 47.9 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 322.1205 |
| Heavy Atoms | 24 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 98755-24-9 |
|---|---|
| SMILES | CC1(C=CC2=CC3=C(C=C2O1)OC4C3COC5=C4C=CC(=C5)O)C |
| InChIKey | WTKJOOHYNMPGLE-UHFFFAOYSA-N |
📖 Product Overview
Isoneorautenol (CAS: 98755-24-9) is a chemical compound with molecular formula C20H18O4 and molecular weight 322.4 g/mol. Its IUPAC systematic name is 7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14(19),15,17-heptaen-17-ol.
WTKJOOHYNMPGLE-UHFFFAOYSA-N.
SMILES: CC1(C=CC2=CC3=C(C=C2O1)OC4C3COC5=C4C=CC(=C5)O)C.
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