D-urobilinogen
Chemical Formula:
C33H40N4O6
Molecular Weight:
588.702 Daltons
Monoisotopic Mass:
590.3104351016 Daltons
SMILES:
CCC1(=C(C(=O)NC1CC2(=C(C)C(CCC(=O)[O-])=C(N2)CC3(NC(=C(C)C(CCC(=O)[O-])=3)CC4(NC(C(C=C)=C(C)4)=O))))C)
InChI:
1S/C33H42N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h8,26-27,34-35H,2,7,9-15H2,1,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/p-2
InChIKey:
Databases
MetaCyc:
CPD-17978
RefMet:
D-Urobilinogen
KEGG:
C05791
ChEBI:
4260
Seed:
cpd03431
HMDB:
HMDB04158
MetaNetX:
MNXM3249