7-hydroxy-6-methyl-8-(2,3,4,5-tetrahydroxypentyl)-2,3,4,8-tetrahydropteridine-2,4-dione

AlkaPlorer ID: AK357265

Synonym: None

IUPAC Name: 6-methyl-8-[(2R,3R,4S)-2,3,4,5-tetrahydroxypentyl]-1H-pteridine-2,4,7-trione

Structure

SMILES: CC1=C(O)N(C[C@@H](O)[C@@H](O)[C@@H](O)CO)C2=NC(=O)N=C(O)C2=N1

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InChI: InChI=1S/C12H16N4O7/c1-4-11(22)16(2-5(18)8(20)6(19)3-17)9-7(13-4)10(21)15-12(23)14-9/h5-6,8,17-20,22H,2-3H2,1H3,(H,15,21,23)/t5-,6+,8-/m1/s1

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InChIKey: COXMGTTXHPRZBO-GKROBHDKSA-N

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Source

Properties Information

Molecule Weight: 328.28100000000006

TPSA: 182.05

MolLogP: -3.06728

Number of H-Donors: 6

Number of H-Acceptors: 11

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information