4-hydroxy-2-imino-1,2,4a,7,8,8a-hexahydropteridin-7-one

AlkaPlorer ID: AK127380

Synonym: None

IUPAC Name: 2-amino-3,4a,8,8a-tetrahydropteridine-4,7-dione

Structure

SMILES: N=C1N=C(O)C2N=CC(=O)NC2N1

copy

InChI: InChI=1S/C6H7N5O2/c7-6-10-4-3(5(13)11-6)8-1-2(12)9-4/h1,3-4H,(H,9,12)(H3,7,10,11,13)

copy

InChIKey: CMOXKYQQTMHEHE-UHFFFAOYSA-N

copy

Reference

PubChem CID: 57336529

CAS: 529-69-1

NPASS: NPC274405

COCONUT: CNP0076184

Properties Information

Molecule Weight: 181.155

TPSA: 109.93

MolLogP: -1.62383

Number of H-Donors: 4

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information