5,8-Dideazapteroylornithine
[CAS# 118675-83-5]

Identification

• Name: 5,8-Dideazapteroylornithine
• Synonyms: (2S)-5-Amino-2-[[[4-[(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)Methylamino]Phenyl]-Oxomethyl]Amino]Pentanoic Acid; (2S)-5-Amino-2-[[4-[(2-Amino-4-Keto-1H-Quinazolin-6-Yl)Methylamino]Benzoyl]Amino]Valeric Acid; (2S)-5-Amino-2-[[4-[(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)Methylamino]Phenyl]Carbonylamino]Pentanoic Acid
• Molecular Formula: C₂₁H₂₄N₆O₄
• Molecular Weight: 424.46
• CAS Registry Number: 118675-83-5
• SMILES: [C@H](C(=O)O)(NC(C1=CC=C(C=C1)NCC3=CC2=C(NC(=NC2=O)N)C=C3)=O)CCCN
• InChI: 1S/C21H24N6O4/c22-9-1-2-17(20(30)31)25-18(28)13-4-6-14(7-5-13)24-11-12-3-8-16-15(10-12)19(29)27-21(23)26-16/h3-8,10,17,24H,1-2,9,11,22H2,(H,25,28)(H,30,31)(H3,23,26,27,29)/t17-/m0/s1
• InChIKey: XXHSFOMKJAVUID-KRWDZBQOSA-N