3-hydroxy-4-methylanthranilyl-adenylate
Chemical Formula:
C18H20N6O9P
Molecular Weight:
495.365 Daltons
Monoisotopic Mass:
496.1107628142 Daltons
SMILES:
CC1(=C(O)C(N)=C(C=C1)C(=O)OP(OCC4(C(C(C(N3(C2(=C(C(=NC=N2)N)N=C3)))O4)O)O))([O-])=O)
InChI:
1S/C18H21N6O9P/c1-7-2-3-8(10(19)12(7)25)18(28)33-34(29,30)31-4-9-13(26)14(27)17(32-9)24-6-23-11-15(20)21-5-22-16(11)24/h2-3,5-6,9,13-14,17,25-27H,4,19H2,1H3,(H,29,30)(H2,20,21,22)/p-1/t9-,13-,14-,17-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-18448
ChEBI:
91232
PubChem (CID):
102515308
MetaNetX:
MNXM162630
KEGG:
C21460