Catalog Number:
AG000XFP
Chemical Name:
5,10,15,20-Tetrakis(4-carboxymethyloxyphenyl)-21h,23h-porphine
CAS Number:
127812-08-2
Molecular Formula:
C52H38N4O12
Molecular Weight:
910.8777
MDL Number:
MFCD00191499
IUPAC Name:
2-[4-[10,15,20-tris[4-(carboxymethoxy)phenyl]-21,23-dihydroporphyrin-5-yl]phenoxy]acetic acid
InChI:
InChI=1S/C52H38N4O12/c57-45(58)25-65-33-9-1-29(2-10-33)49-37-17-19-39(53-37)50(30-3-11-34(12-4-30)66-26-46(59)60)41-21-23-43(55-41)52(32-7-15-36(16-8-32)68-28-48(63)64)44-24-22-42(56-44)51(40-20-18-38(49)54-40)31-5-13-35(14-6-31)67-27-47(61)62/h1-24,53,56H,25-28H2,(H,57,58)(H,59,60)(H,61,62)(H,63,64)
InChI Key:
GIHZJFIAJYZVFA-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1ccc(cc1)OCC(=O)O)C=C3)c1ccc(cc1)OCC(=O)O)[nH]2)c1ccc(cc1)OCC(=O)O
