protoporphyrin IX
Chemical Formula:
C34H32N4O4
Molecular Weight:
560.651 Daltons
Monoisotopic Mass:
562.2580056006001 Daltons
SMILES:
C=CC1(C(C)=C2(C=C5(C(C)=C(CCC([O-])=O)C(C=C4(C(CCC([O-])=O)=C(C)C(=CC3(C(C=C)=C(C)C(=CC=1N2)N=3))N4))=N5)))
InChI:
1S/C34H34N4O4/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25/h7-8,13-16,35,38H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42)/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-
InChIKey:
Databases
MetaCyc:
PROTOPORPHYRIN_IX
RefMet:
Protoporphyrin
BiGG:
ppp9
HMDB:
HMDB00241
ChemSpider:
20171337
ChEBI:
57306
PubChem (CID):
3794562
KEGG:
C02191
CAS:
553-12-8
Seed:
cpd01476
MetaNetX:
MNXM346