Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C20H25N7O6
- Molecular weight
- 459.5 g/mol
- IUPAC name
- (2S)-2-[[4-[[(6S)-2-amino-5-methyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid
- SMILES
- CN1[C@H](CNC2=C1C(=O)N=C(N2)N)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
- InChIKey
- ZNOVTXRBGFNYRX-STQMWFEESA-N
- XLogP
- -0.5
- Polar surface area
- 198 Ų
- H-bond donors
- 7
- H-bond acceptors
- 9
- Formal charge
- 0
via PubChem
Wikidata facts
- Mass
- 459.18663152000005
Show 5 more facts
- chemical formula
- C₂₀H₂₅N₇O₆
- canonical SMILES
- CN1C(CNC2=C1C(=O)N=C(N2)N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O
- isomeric SMILES
- CN1[C@@H](CNC2=CC=C(C=C2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CNC3=C1C(=O)N=C(N)N3
- NCI Thesaurus ID
- C81119
- found in taxon
- Homo sapiens
via Wikidata · CC0