Bioactive Compound Details
| BioID | bio198414 |
|---|---|
| Name | FLUTAX 2 |
| ChEMBL ID | CHEMBL509241 |
| Molecular Formula | C71H64F2N2O21 |
| Molecular Weight | 1319.28 |
| Molecular Weight (Monoisotopic) | 1318.397 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Flutax 2 |
| Smiles | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](OC(=O)[C@H](C)NC(=O)c3ccc(-c4c5cc(F)c(=O)cc-5oc5cc(O)c(F)cc45)c(C(=O)O)c3)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |
| Inchi | InChI=1S/C71H64F2N2O21/c1-33-51(93-67(88)57(80)56(37-17-11-8-12-18-37)75-62(82)38-19-13-9-14-20-38)31-71(89)61(95-66(87)39-21-15-10-16-22-39)59-69(7,60(81)58(91-35(3)76)55(33)68(71,5)6)52(30-53-70(59,32-90-53)96-36(4)77)94-65(86)34(2)74-63(83)40-23-24-41(42(25-40)64(84)85)54-43-26-45(72)47(78)28-49(43)92-50-29-48(79)46(73)27-44(50)54/h8-29,34,51-53,56-59,61,78,80,89H,30-32H2,1-7H3,(H,74,83)(H,75,82)(H,84,85)/t34-,51-,52-,53+,56-,57+,58+,59-,61-,69+,70-,71+/m0/s1 |
| Inchi Key | UTOYCOKRJWZPNT-SQNCZLKBSA-N |
| Molecular Species | None |
| Targets | 2.0 |
| Bioactivities | 6.0 |
| Np Likeness Score | None |
| Records Key | ['7, Flutax-2', '2b'] |
| Records Name | [7-O-(N-(2,7-difluoro-4'-fluoresceincarbonyl)-L-alanyl)paclitaxol", 'flutax-2']" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
