Catalog Number:
AG009DCY
Chemical Name:
N-METHYL MESOPORPHYRIN IX
CAS Number:
142234-85-3
Molecular Formula:
C35H40N4O4
Molecular Weight:
580.7165
MDL Number:
MFCD00216786
IUPAC Name:
3-[18-(2-carboxyethyl)-7,12-diethyl-3,8,13,17,22-pentamethyl-23H-porphyrin-2-yl]propanoic acid
InChI:
InChI=1S/C35H40N4O4/c1-8-22-18(3)26-14-27-19(4)24(10-12-34(40)41)29(36-27)15-30-25(11-13-35(42)43)20(5)28(38-30)16-33-23(9-2)21(6)32(39(33)7)17-31(22)37-26/h14-17,37H,8-13H2,1-7H3,(H,40,41)(H,42,43)
InChI Key:
XODZICXILWCPBD-UHFFFAOYSA-N
SMILES:
CCC1=C(C)C2=N/C/1=C\c1c(C)c(c(n1C)/C=C/1\N=C(/C=c/3\[nH]/c(=C\2)/c(C)c3CCC(=O)O)C(=C1C)CCC(=O)O)CC
