Compound Summary
Compound Information
actinonin
Compound Name: | actinonin |
Compound CID: | 443600 |
Synonyms: | actinonin |
Iupac Name: | (2R)-N'-hydroxy-N-[(2S)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-pentylbutanediamide |
InChI: | InChI=1S/C19H35N3O5/c1-4-5-6-8-14(11-16(24)21-27)18(25)20-17(13(2)3)19(26)22-10-7-9-15(22)12-23/h13-15,17,23,27H,4-12H2,1-3H3,(H,20,25)(H,21,24)/t14-,15+,17+/m1/s1 |
InChIKey: | XJLATMLVMSFZBN-VYDXJSESSA-N |
Canonical Smiles: | CCCCCC(CC(=O)NO)C(=O)NC(C(C)C)C(=O)N1CCCC1CO |
Isomeric Smiles: | CCCCC[C@H](CC(=O)NO)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1CO |
Molecular Weight: | 385.5 |
Molecular Formula: | C19H35N3O5 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
actinonin
Molecular Weight: | 385.5 |
Molecular Formula: | C19H35N3O5 |
Hydrogen Bond Donor Count: | 4 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 11 |
Heavy Atom Count: | 27 |
Complexity: | 498 |
Synonyms
actinonin
Experimental Data
actinonin
Experimental Data Visualization
actinonin
Statistics Data
actinonin
Statistics Data Visualization
actinonin
