Chemical Components in the PDB

pdbe.org/chem
spacer

PDBeChem : Molecule Descriptor

 Molecule : TA1

Encoding of molecule in descriptor string

Name

SMILES

Program

CACTVS

Version

3.341

Name

CC(=O)O[CH]1C(=O)[C]2(C)[CH](O)C[CH]3OC[C]3(OC(C)=O)[CH]2[CH](OC(=O)c4ccccc4)[C]5(O)C[CH](OC(=O)[CH](O)[CH](NC(=O)c6ccccc6)c7ccccc7)C(=C1C5(C)C)C