Erythropterin

AlkaPlorer ID: AK297917

Synonym: 3-(2-Amino-4,5,6,8-tetrahydro-4,6-dioxo-7(3H)-pteridinylidene)-2-oxopropanoic acid 

IUPAC Name: 3-(2-amino-4,6-dioxo-3,5-dihydropteridin-7-yl)-2-hydroxyprop-2-enoic acid

Structure

SMILES: N=C1N=C(O)C2=C(N/C(=C\C(=O)C(=O)O)C(O)=N2)N1

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InChI: InChI=1S/C9H7N5O5/c10-9-13-5-4(7(17)14-9)12-6(16)2(11-5)1-3(15)8(18)19/h1H,(H,12,16)(H,18,19)(H4,10,11,13,14,17)/b2-1-

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InChIKey: BNJFLPKUALUAFG-UPHRSURJSA-N

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Reference

CAS: 7449-03-8

NPASS: NPC265345

Properties Information

Molecule Weight: 265.18499999999995

TPSA: 171.74999999999997

MolLogP: -0.8541300000000003

Number of H-Donors: 6

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information