mycophenolate
Chemical Formula:
C17H19O6
Molecular Weight:
319.333 Daltons
Monoisotopic Mass:
320.1259883746 Daltons
SMILES:
CC(CCC([O-])=O)=CCC1(=C(C(C)=C2(COC(=O)C(=C(O)1)2))OC)
InChI:
1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/p-1/b9-4+
InChIKey:
Synonyms
- mycophenolic acid
Databases
MetaCyc:
CPD-14601
PubChem (CID):
6918995
ChEBI:
62932
Reactome:
5694565
HMDB:
HMDB15159
MetaNetX:
MNXM7547
KEGG:
C20380