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6-[[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]amino]hexanoic acid
6-[[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]amino]hexanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)NCCCCCC(=O)O
Isomeric SMILES
C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)NCCCCCC(=O)O
InChI
InChI=1S/C18H21N5O3/c24-14(25)9-5-2-6-10-19-18-21-16-15(17(26)22-18)23(12-20-16)11-13-7-3-1-4-8-13/h1,3-4,7-8,12H,2,5-6,9-11H2,(H,24,25)(H2,19,21,22,26)
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