Ichthyopterin

AlkaPlorer ID: AK302299

Synonym: 2-Amino-6-(1,2-dihydroxypropyl)-4,7(1H,8H)-pteridinedione, 6-(1,2-Dihydroxypropyl)isoxanthopterin, 7-Hydroxybiopterin, 2-Amino-4,7-dihydroxy-6-(1,2-dihydroxypropyl)pteridine 

IUPAC Name: 2-amino-6-(1,2-dihydroxypropyl)-3,8-dihydropteridine-4,7-dione

Structure

SMILES: CC(O)C(O)C1=C(O)N=C2NC(=N)N=C(O)C2=N1

copy

InChI: InChI=1S/C9H11N5O4/c1-2(15)5(16)3-7(17)12-6-4(11-3)8(18)14-9(10)13-6/h2,5,15-16H,1H3,(H4,10,12,13,14,17,18)

copy

InChIKey: IZMMJLZUJAZKES-UHFFFAOYSA-N

copy

Reference

PubChem CID: 135449065

CAS: 23259-60-1

NPASS: NPC10437

COCONUT: CNP0138528.1

Properties Information

Molecule Weight: 253.218

TPSA: 159.23000000000002

MolLogP: -1.3422300000000005

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information