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Molfile:
Ideal
Representative
PDB:
Ideal
Representative
Other:
mmCif
CML
Related compounds
THG
(Stereoisomer)
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Ideal
Representative
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PDBeChem
: Molecule Descriptor
Molecule :
1YJ
Encoding of molecule in descriptor string
Name
Canonical SMILES
Program
OpenEye OEToolkits
Version
1.7.6
Name
c1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC[C@@H]2CNC3=C(N2)C(=O)NC(=N3)N