Chemical Component Summary

NameCHLOROPHYLL A
Identifiersn/a
FormulaC55 H72 Mg N4 O5
Molecular Weight893.489
TypeNON-POLYMER
Isomeric SMILESCCC1=C(C2=Cc3c(c(c4n3[Mg]56[N]2=C1C=C7N5C8=C([C@H](C(=O)C8=C7C)C(=O)OC)C9=[N]6C(=C4)[C@H]([C@@H]9CCC(=O)OC/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C)C)C=C)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;+2/p-1/b34-26+;/t32-,33-,37+,41+,51-;/m1./s1
InChIKeyATNHDLDRLWWWCB-AENOIHSZSA-M

Chemical Details

Formal Charge0
Atom Count137
Chiral Atom Count6
Bond Count145
Aromatic Bond Count5

Drug Info: DrugBank

DrugBank IDDB02133 
NameChlorophyll A
Groups experimental
SynonymsChlorophyll A
Categories
  • Chlorophyll
  • Heterocyclic Compounds, Fused-Ring
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

Related Resource References

Resource NameReference
PubChem 44602414, 13557925, 12085802, 16667503