Catalog Number:
AG00AQMV
Chemical Name:
6-Benzoylamino-9H-purine-9-acetic acid
CAS Number:
171486-04-7
Molecular Formula:
C14H11N5O3
Molecular Weight:
297.2688
MDL Number:
MFCD28969246
IUPAC Name:
2-(6-benzamidopurin-9-yl)acetic acid
InChI:
InChI=1S/C14H11N5O3/c20-10(21)6-19-8-17-11-12(15-7-16-13(11)19)18-14(22)9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H,20,21)(H,15,16,18,22)
InChI Key:
XSEJMYVTSMVKPG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Nc1ncnc2c1ncn2CC(=O)O
