2-[5-methoxy-2-(6'-methoxy-1',3',4',9'a-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4'a(2'H)-yl)phenoxy]propanoic acid
Chemical Structure Depiction of
2-[5-methoxy-2-(6'-methoxy-1',3',4',9'a-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4'a(2'H)-yl)phenoxy]propanoic acid
2-[5-methoxy-2-(6'-methoxy-1',3',4',9'a-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4'a(2'H)-yl)phenoxy]propanoic acid
Compound characteristics
| Compound ID: | 8015-4992 |
| Compound Name: | 2-[5-methoxy-2-(6'-methoxy-1',3',4',9'a-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4'a(2'H)-yl)phenoxy]propanoic acid |
| Molecular Weight: | 480.6 |
| Molecular Formula: | C29 H36 O6 |
| Smiles: | CC(C(O)=O)Oc1cc(ccc1C12CCCCC1C1(CCCCC1)c1ccc(cc1O2)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3014 |
| logD: | 2.302 |
| logSw: | -5.2584 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.821 |
| InChI Key: | XGAICFLKIPNUFE-UHFFFAOYSA-N |