10-Acetyl-5,8-Dideazafolic Acid
[CAS# 94843-77-3]

Identification

• Name: 10-Acetyl-5,8-Dideazafolic Acid
• Synonyms: (2S)-2-[[[4-[Acetyl-[(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)Methyl]Amino]Phenyl]-Oxomethyl]Amino]Pentanedioic Acid; (2S)-2-[[4-[Acetyl-[(2-Amino-4-Keto-1H-Quinazolin-6-Yl)Methyl]Amino]Benzoyl]Amino]Glutaric Acid; (2S)-2-[[4-[(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)Met
• Molecular Formula: C₂₃H₂₃N₅O₇
• Molecular Weight: 481.46
• CAS Registry Number: 94843-77-3
• SMILES: [C@H](C(=O)O)(NC(C1=CC=C(C=C1)N(CC3=CC2=C(NC(=NC2=O)N)C=C3)C(=O)C)=O)CCC(=O)O
• InChI: 1S/C23H23N5O7/c1-12(29)28(11-13-2-7-17-16(10-13)21(33)27-23(24)26-17)15-5-3-14(4-6-15)20(32)25-18(22(34)35)8-9-19(30)31/h2-7,10,18H,8-9,11H2,1H3,(H,25,32)(H,30,31)(H,34,35)(H3,24,26,27,33)/t18-/m0/s1
• InChIKey: YSALQHPMBKCQDP-SFHVURJKSA-N