Bioactive Compound Details
| BioID | bio3523 |
|---|---|
| Name | SERINE AURISTATIN TP |
| ChEMBL ID | CHEMBL1784333 |
| Molecular Formula | C42H75N6O13P |
| Molecular Weight | 903.07 |
| Molecular Weight (Monoisotopic) | 902.513 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar18 |
| Target Name | Serine/threonine-protein kinase cot (COT) |
| Synonyms | Serine Auristatin TP |
| Smiles | CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)NCCc1ccc(OP(=O)(O)O)cc1)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)C.N[C@@H](CO)C(=O)O |
| Inchi | InChI=1S/C39H68N5O10P.C3H7NO3/c1-13-26(6)35(43(10)39(48)33(24(2)3)41-38(47)34(25(4)5)42(8)9)31(52-11)23-32(45)44-22-14-15-30(44)36(53-12)27(7)37(46)40-21-20-28-16-18-29(19-17-28)54-55(49,50)51;4-2(1-5)3(6)7/h16-19,24-27,30-31,33-36H,13-15,20-23H2,1-12H3,(H,40,46)(H,41,47)(H2,49,50,51);2,5H,1,4H2,(H,6,7)/t26-,27+,30-,31+,33-,34-,35-,36+;2-/m00/s1 |
| Inchi Key | UBUXBEHXSBCDSJ-UBNZNYKISA-N |
| Molecular Species | None |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | None |
| Records Key | ['3g'] |
| Records Name | ['Serine Auristatin TP'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
