input word = C00000323

Metabolite InformationStructural formula
Name Methyl pheophorbide b
Formula C36H36N4O6
Mw 620.26348491
CAS RN 5522-71-4
C_ID C00000323 ,
InChIKey NUQASTRTTSQPAJ-HEFOWENTNA-N
InChICode InChI=1S/C36H36N4O6/c1-8-19-16(3)23-12-24-17(4)21(10-11-29(42)45-6)33(39-24)31-32(36(44)46-7)35(43)30-18(5)25(40-34(30)31)13-27-20(9-2)22(15-41)28(38-27)14-26(19)37-23/h8,12-15,17,21,32,37,40H,1,9-11H2,2-7H3/b23-12?,24-12-,25-13-,26-14-,27-13-,28-14-,33-31-/t17-,21-,32-/m0/s1
SMILES C=Cc1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C=O)=C6CC)c(C)c5C(=O)[C@@H]4C(=O)OC)[C@@H](CCC(=O)OC)[C@@H]3C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeEbenaceaeDiospyros kaki Ref.
zoom in