2-[(7S)-2-azanyl-8-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]-6-oxidanylidene-5,7-dihydropteridin-7-yl]propanoic acid

Systemtic Name: 2-[(7S)-2-azanyl-8-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]-6-oxidanylidene-5,7-dihydropteridin-7-yl]propanoic acid Openeye Name: 2-[(7S)-2-amino-8-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-6-oxo-5,7-dihydropteridin-7-yl]propanoic acid CAS Name: 2-[(7S)-2-amino-8-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-6-oxo-5,7-dihydropteridin-7-yl]propanoic acid IUPAC Name: 2-[(7S)-2-amino-8-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]-6-oxo-5,7-dihydropteridin-7-yl]propanoic acid Traditional Name: 2-[(7S)-2-amino-6-keto-8-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-5,7-dihydropteridin-7-yl]propionic acid Formula: C18H22N6O4 MolecularWeight: 386.40508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1OC)C)CN2C(C(=O)NC3=CN=C(N=C32)N)C(C)C(=O)O

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)CN2[C@H](C(=O)NC3=CN=C(N=C32)N)C(C)C(=O)O

InChI

InChI=1S/C18H22N6O4/c1-8-5-20-12(9(2)14(8)28-4)7-24-13(10(3)17(26)27)16(25)22-11-6-21-18(19)23-15(11)24/h5-6,10,13H,7H2,1-4H3,(H,22,25)(H,26,27)(H2,19,21,23)/t10?,13-/m0/s1