PRD_002282
Trapoxin A
PRD_002282 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).
The representative PDB ID is 5VI6.
Chemical Component Summary | |
|---|---|
| Name | Trapoxin A |
| Identifiers | (3~{S},6~{S},9~{S},12~{R})-9-[6,6-bis(oxidanyl)-6-[(2~{S})-oxiran-2-yl]hexyl]-3,6-bis(phenylmethyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone |
| Formula | C34 H44 N4 O7 |
| Molecular Weight | 620.736 |
| Type | PEPTIDE-LIKE |
| Isomeric SMILES | c1ccc(cc1)C[C@H]2C(=O)N[C@H](C(=O)N3CCCC[C@@H]3C(=O)N[C@H](C(=O)N2)CCCCCC([C@@H]4CO4)(O)O)Cc5ccccc5 |
| InChI | InChI=1S/C34H44N4O7/c39-30-25(16-8-3-10-18-34(43,44)29-22-45-29)35-32(41)28-17-9-11-19-38(28)33(42)27(21-24-14-6-2-7-15-24)37-31(40)26(36-30)20-23-12-4-1-5-13-23/h1-2,4-7,12-15,25-29,43-44H,3,8-11,16-22H2,(H,35,41)(H,36,39)(H,37,40)/t25-,26-,27-,28+,29-/m0/s1 |
| InChIKey | IQEGEIYGULTIMD-CNXZJCAJSA-N |
| Composition | Polymer Sequences: PHE-PHE-CPI-5OM |
| BIRD class | INHIBITOR |
| Represented As | POLYMER |
| Compound Details | n/a |
| Description | n/a |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 89 |
| Chiral Atom Count | 5 |
| Bond Count | 93 |
| Aromatic Bond Count | 12 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 129900191 |
