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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OrganismArnebia euchroma
ReferenceYin, et al., Modern Study of Chinese Drugs and Clinical Applications (1), Xueyuan Press, Beijing, (1993).

Sun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).

Chinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999).

Zhang, et al., NPRD, 14, (2002), 74.

Calixto, et al., Planta Med, 70, (2004), 93.

Hu, et al., Planta Med, 70, (2004), 23.

Ou, et al., Brief Handbook of Components of Traditional Chinese Medicines, The People's Medical Publishing House, Beijing, (2003).

Chen, Liu, et al., Determination of Effective Components in Traditional Chinese medicines, People's Medical Publishing House, Beijing, (2009)