(11Z)-11-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthen-12-one
Chemical Structure Depiction of
(11Z)-11-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthen-12-one
(11Z)-11-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthen-12-one
Compound characteristics
| Compound ID: | C247-0025 |
| Compound Name: | (11Z)-11-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthen-12-one |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C27 H29 N O6 |
| Smiles: | COc1ccc(/C=C/C(=C2\C3C4CCCCC4(NC2=O)Oc2ccccc23)O)c(c1OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2865 |
| logD: | 4.2863 |
| logSw: | -4.3247 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.171 |
| InChI Key: | AIOKGVAXIMGXTO-UHFFFAOYSA-N |