Chemical Component Summary

NameCHLOROPHYLL A
FormulaC55 H72 Mg N4 O5
Molecular Weight893.49
TypeNON-POLYMER
Isomeric SMILESCCC1=C(C)C2=Cc3n4c(C=C5[C@@H](C)[C@H](CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C6=[N@@+]5[Mg]47[N@]8C(=CC1=[N@@+]27)C(=C9C(=O)[C@H](C(=O)OC)C6=C89)C)c(C)c3C=C
InChIInChI=1S/C55H73N4O5.Mg/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42;/h13,26,28-33,37,41,51H,1,14-25,27H2,2-12H3,(H-,56,57,58,59,61);/q-1;+4/p-1/b34-26+;/t32-,33-,37+,41+,51-;/m1./s1
InChIKeyVIQFHHZSLDFWDU-AENOIHSZSA-M

Chemical Details

Formal Charge2
Atom Count137
Chiral Atom Count8
Bond Count145
Aromatic Bond Count5

Drug Info: DrugBank

DrugBank IDDB02133 
NameChlorophyll A
Groupsexperimental
SynonymsChlorophyll A
Categories
  • Biological Factors
  • Chlorophyll
  • Heterocyclic Compounds, Fused-Ring
  • Metalloporphyrins
  • Pigments, Biological
CAS number479-61-8

Drug Targets

NameTarget SequencePharmacological ActionActions
Beta-lactamase 2MKKNTLLKVGLCVGLLGTIQFVSTISSVQASQKVEKTVIKNETGTISISQ...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682