Molecule

2-Amino-4-hydroxypteridine

AlkaPlorer ID: AK020475

Synonym: 2-Amino-4(1H)-pteridinone, 2-Amino-4-pteridinol, Pterin, Pteridoxamine

IUPAC Name: 2-amino-3H-pteridin-4-one

SMILES: NC1=NC(O)=C2N=CC=NC2=N1

InChI: InChI=1S/C6H5N5O/c7-6-10-4-3(5(12)11-6)8-1-2-9-4/h1-2H,(H3,7,9,10,11,12)

InChIKey: HNXQXTQTPAJEJL-UHFFFAOYSA-N

PubChem CID: 135398660

CAS: 100643-15-0

LOTUS: LTS0037410

NPASS: NPC19660

COCONUT: CNP0238589

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Glycine max	Glycine	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 163.13999999999996

TPSA？: 97.81

MolLogP？: -0.2924

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 2

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Zymomonas mobilis (strain ATCC 31821 / ZM4 / CP4)	tRNA-guanine transglycosylase	Ki	600.0	nM	10.1021/jm0209937

AKRT ID	Reaction	Reaction Link ID
AKRT001102	*c1nc2c(O)nc(N)nc2nc1O>>Nc1nc(O)c2nccnc2n1	MNXR184993
AKRT016369	N=c1[nH]c(=O)c2nccnc2[nH]1>>O=c1[nH]c(=O)c2nccnc2[nH]1	enzymemap_79067
AKRT021103	Nc1nc(O)c2ncc(O)nc2n1>>Nc1nc(O)c2nccnc2n1	MNXR175671
AKRT021203	Nc1nc2c(c(=O)[nH]1)N=CCN2>>Nc1nc2nccnc2c(=O)[nH]1	RXN-15269
AKRT021610	Nc1nc2nccnc2c(=O)[nH]1>>Nc1nc2c(c(=O)[nH]1)N=CCN2	enzymemap_23044