4-[[4-(6-aminopurin-9-yl)-2,3-bis(oxidanyl)cyclopentyl]methylsulfanyl]-2-azanyl-butanoic acid

Systemtic Name: 4-[[4-(6-aminopurin-9-yl)-2,3-bis(oxidanyl)cyclopentyl]methylsulfanyl]-2-azanyl-butanoic acid Openeye Name: 2-amino-4-[[4-(6-aminopurin-9-yl)-2,3-dihydroxy-cyclopentyl]methylsulfanyl]butanoic acid CAS Name: 2-amino-4-[[4-(6-aminopurin-9-yl)-2,3-dihydroxycyclopentyl]methylthio]butanoic acid IUPAC Name: 2-amino-4-[[4-(6-aminopurin-9-yl)-2,3-dihydroxycyclopentyl]methylsulfanyl]butanoic acid Traditional Name: 4-[(4-adenin-9-yl-2,3-dihydroxy-cyclopentyl)methylthio]-2-amino-butyric acid Formula: C15H22N6O4S MolecularWeight: 382.43798

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1N2C=NC3=C2N=CN=C3N)O)O)CSCCC(C(=O)O)N

Isomeric SMILES

C1C(C(C(C1N2C=NC3=C2N=CN=C3N)O)O)CSCCC(C(=O)O)N

InChI

InChI=1S/C15H22N6O4S/c16-8(15(24)25)1-2-26-4-7-3-9(12(23)11(7)22)21-6-20-10-13(17)18-5-19-14(10)21/h5-9,11-12,22-23H,1-4,16H2,(H,24,25)(H2,17,18,19)