Bioactive Compound Details
| BioID | bio199405 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1651280 |
| Molecular Formula | C27H30O15 |
| Molecular Weight | 594.52 |
| Molecular Weight (Monoisotopic) | 594.1585 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2'-O-Rhamnosylisoorietin |
| Smiles | C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c2c(O)cc3oc(-c4ccc(O)c(O)c4)cc(=O)c3c2O)[C@H](O)[C@H](O)[C@H]1O |
| Inchi | InChI=1S/C27H30O15/c1-8-19(33)22(36)24(38)27(39-8)42-26-23(37)20(34)16(7-28)41-25(26)18-13(32)6-15-17(21(18)35)12(31)5-14(40-15)9-2-3-10(29)11(30)4-9/h2-6,8,16,19-20,22-30,32-38H,7H2,1H3/t8-,16+,19-,20+,22+,23-,24+,25-,26+,27-/m0/s1 |
| Inchi Key | IUYFTHKQEWZTHY-QMVGNYJJSA-N |
| Molecular Species | ACID |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 2.18 |
| Records Key | ['5'] |
| Records Name | [2''-O-rhamnosylisoorietin"]" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
