Catalog Number:
AG00FBZ9
Chemical Name:
AICAR (phosphate)
CAS Number:
681006-28-0
Molecular Formula:
C9H17N4O9P
Molecular Weight:
356.2264
MDL Number:
MFCD23726600
IUPAC Name:
5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazole-4-carboxamide;phosphoric acid
InChI:
InChI=1S/C9H14N4O5.H3O4P/c10-7-4(8(11)17)12-2-13(7)9-6(16)5(15)3(1-14)18-9;1-5(2,3)4/h2-3,5-6,9,14-16H,1,10H2,(H2,11,17);(H3,1,2,3,4)/t3-,5-,6-,9-;/m1./s1
InChI Key:
BPVGMEHURDEDAZ-GWTDSMLYSA-N
SMILES:
OP(=O)(O)O.OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc(c1N)C(=O)N
