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2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one

2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one

Systemtic Name:2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one
Openeye Name:2-amino-9-[(1R,4S)-4-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one
CAS Name:2-amino-9-[(1R,4S)-4-(hydroxymethyl)-1-cyclohex-2-enyl]-3H-purin-6-one
IUPAC Name:2-amino-9-[(1R,4S)-4-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one
Traditional Name:2-amino-9-[(1R,4S)-4-methylolcyclohex-2-en-1-yl]-3H-purin-6-one
Formula: C12H15N5O2
MolecularWeight: 261.2798
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C=CC1CO)N2C=NC3=C2NC(=NC3=O)N


Isomeric SMILES

C1C[C@H](C=C[C@H]1CO)N2C=NC3=C2NC(=NC3=O)N


InChI

InChI=1S/C12H15N5O2/c13-12-15-10-9(11(19)16-12)14-6-17(10)8-3-1-7(5-18)2-4-8/h1,3,6-8,18H,2,4-5H2,(H3,13,15,16,19)/t7-,8+/m1/s1


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