6-Amino-2,8-dihydroxypurine; (1H,3H)-form, 1,3-Di-Me 

AlkaPlorer ID: AK100018

Synonym: 6-Amino-1,3-dimethyl-1H-purine-2,8(3H,8H)-dione, 7,9-Dihydro-6-imino-1,3-dimethyl-1H-purine-2,8(3H,6H)-dione, 1,3-Dimethyl-8-oxoisoguanine 

IUPAC Name: 6-imino-1,3-dimethyl-7,9-dihydropurine-2,8-dione

Structure

SMILES: CN1C(=N)C2=C(NC(=O)N2)N(C)C1=O

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InChI: InChI=1S/C7H9N5O2/c1-11-4(8)3-5(10-6(13)9-3)12(2)7(11)14/h8H,1-2H3,(H2,9,10,13)

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InChIKey: QODFADPTUYFJNH-UHFFFAOYSA-N

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Reference

PubChem CID: 135577860

COCONUT: CNP0163278

Properties Information

Molecule Weight: 195.182

TPSA: 99.43

MolLogP: -1.62713

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information