| Name |
Chlorophyll a |
| Formula |
C55H72MgN4O5 |
| Mw |
892.53531331 |
| CAS RN |
479-61-8 |
| C_ID |
C00001528
, 
|
| InChIKey |
VIQFHHZSLDFWDU-XLLNUUMUNA-M |
| InChICode |
InChI=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 |
| SMILES |
c12c(c(c3n1[Mg]14[N+]5=C([C@@H]([C@H](C5=C3)C)CCC(=O)OC/C=C(\C)/CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C3=c5n1c(=CC1=[N+]4C(=C2)C(=C1CC)C)c(c5C(=O)[C@@H]3C(=O)OC)C)C)C=C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Anacardiaceae | Mangifera indica  | Ref. |
| Plantae | Cruciferae | Arabidopsis thaliana | Ref. |
| Plantae | Cruciferae | Brassica oleracea var. italica | Ref. |
| Plantae | Rubiaceae | Coffea arabica | Ref. |
| Plantae | Rubiaceae | Coffea canephora | Ref. |
| Plantae | Solanaceae | Solanum tuberosum | Ref. |
|
|
zoom in
| Organism | Coffea arabica |
|---|
| Reference | Simkin, A. J. et al., J. Plant Physiol., 165, (2008), 1087-1106. |
|---|
|
