input word = C00000859

Metabolite InformationStructural formula
Name Shikonin
Formula C16H16O5
Mw 288.09977362
CAS RN 517-89-5
C_ID C00000859 ,
InChIKey NEZONWMXZKDMKF-UEQNJFAPNA-N
InChICode InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3/t10-/m1/s1
SMILES c1cc(c2c(c1O)C(=O)C(=CC2=O)[C@@H](CC=C(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStaphylococcaceaeStaphylococcus aureus Ref.
PlantaeBoraginaceaeArnebia euchroma Ref.
PlantaeBoraginaceaeArnebia guttata Ref.
PlantaeBoraginaceaeLithospermum erythrorhizon Ref.
PlantaeBoraginaceaeLithospermum officinale Ref.
PlantaeBoraginaceaeOnosma paniculatum Ref.
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OrganismLithospermum officinale
ReferenceKrivoshchekova,Khim.Prir.Soedin.,(1976),726