| BioID | bio197432 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL464109 |
|---|
| Molecular Formula | C21H18O6 |
|---|
| Molecular Weight | 366.37 |
|---|
| Molecular Weight (Monoisotopic) | 366.1103 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | (6As,11As)-2-Hydroxyleiocarpin |
|---|
| Smiles | CC1(C)C=Cc2c(c(O)cc3c2OC[C@@H]2c4cc5c(cc4O[C@H]32)OCO5)O1 |
|---|
| Inchi | InChI=1S/C21H18O6/c1-21(2)4-3-10-18-12(5-14(22)20(10)27-21)19-13(8-23-18)11-6-16-17(25-9-24-16)7-15(11)26-19/h3-7,13,19,22H,8-9H2,1-2H3/t13-,19-/m1/s1 |
|---|
| Inchi Key | JEDDWGYBFZMEOV-BFUOFWGJSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | 2.75 |
|---|
| Records Key | ['1'] |
|---|
| Records Name | ['(6aS,11aS)-2-Hydroxyleiocarpin'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
