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4-[1-[(2,4-Diamino-6-pteridinyl)methyl]-3-butynyl]benzoic acid

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Catalog Number	PR146464939
CAS	146464-93-9
Structure
Synonyms	10-Propargyl-4-deoxy-4-amino-10-deazapteroic acid
IUPAC Name	4-[1-(2,4-diaminopteridin-6-yl)pent-4-yn-2-yl]benzoic acid
Molecular Weight	348.4
Molecular Formula	C18H16N6O2
InChI	YDEZNQPWTMVPCH-UHFFFAOYSA-N
InChI Key	InChI=1S/C18H16N6O2/c1-2-3-12(10-4-6-11(7-5-10)17(25)26)8-13-9-21-16-14(22-13)15(19)23-18(20)24-16/h1,4-7,9,12H,3,8H2,(H,25,26)(H4,19,20,21,23,24)
Applications/Corresponding APIs	Pralatexate
EC Number	695-812-0
Isomeric SMILES	C#CCC(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)O

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