(10Z)-10-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-2,3,9,9a-tetrahydro-1H-3a,9-(epiminoethano)benzo[b]cyclopenta[e]pyran-11-one
Chemical Structure Depiction of
(10Z)-10-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-2,3,9,9a-tetrahydro-1H-3a,9-(epiminoethano)benzo[b]cyclopenta[e]pyran-11-one
(10Z)-10-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-2,3,9,9a-tetrahydro-1H-3a,9-(epiminoethano)benzo[b]cyclopenta[e]pyran-11-one
Compound characteristics
| Compound ID: | C247-0024 |
| Compound Name: | (10Z)-10-[(2E)-1-hydroxy-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-ylidene]-2,3,9,9a-tetrahydro-1H-3a,9-(epiminoethano)benzo[b]cyclopenta[e]pyran-11-one |
| Molecular Weight: | 449.5 |
| Molecular Formula: | C26 H27 N O6 |
| Smiles: | COc1ccc(/C=C/C(=C2\C3C4CCCC4(NC2=O)Oc2ccccc23)O)c(c1OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7907 |
| logD: | 3.7906 |
| logSw: | -4.1514 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.537 |
| InChI Key: | HZUFXVHPBANMHD-UHFFFAOYSA-N |