input word = C00003297

Metabolite InformationStructural formula
Name Grosshemin
Formula C15H18O4
Mw 262.12050906
CAS RN 22489-66-3
C_ID C00003297 ,
InChIKey YGMIBVIKXJJQQJ-JWFQEDRYNA-N
InChICode InChI=1S/C15H18O4/c1-6-4-11(17)13-8(3)15(18)19-14(13)12-7(2)10(16)5-9(6)12/h7,9,11-14,17H,1,3-5H2,2H3/t7-,9+,11+,12+,13-,14-/m1/s1
SMILES [C@@H]12[C@@H]([C@@H]3[C@@H]([C@H](CC1=C)O)C(=C)C(=O)O3)[C@@H](C(=O)C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentaurea lippii Ref.
PlantaeAsteraceaeChartolepis intermedia Ref.
PlantaeAsteraceaeCynara scolymus Ref.
PlantaeAsteraceaeGrossheimia macrocephala Ref.
PlantaeAsteraceaeVenidium decurrens Ref.
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