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5-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)pentanoic acid

5-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name:5-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)pentanoic acid
Openeye Name:5-(6-aminopurin-9-yl)-2-(benzyloxycarbonylamino)pentanoic acid
CAS Name:5-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)pentanoic acid
IUPAC Name:5-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)pentanoic acid
Traditional Name:5-adenin-9-yl-2-(benzyloxycarbonylamino)valeric acid
Formula: C18H20N6O4
MolecularWeight: 384.3892
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCN2C=NC3=C2N=CN=C3N)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCN2C=NC3=C2N=CN=C3N)C(=O)O


InChI

InChI=1S/C18H20N6O4/c19-15-14-16(21-10-20-15)24(11-22-14)8-4-7-13(17(25)26)23-18(27)28-9-12-5-2-1-3-6-12/h1-3,5-6,10-11,13H,4,7-9H2,(H,23,27)(H,25,26)(H2,19,20,21)


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