Compound Description

ID:   C0856 Common name:   Acetylshikonin
IUPAC:  [(1R)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate CAS:  CAS:24502-78-1
Chembl ID:   CHEMBL403516 Pubchem ID:   CID:479501
Formula:  C18H18O6 TCM-ID:  TCMC624
Smiles:  CC(=O)O[C@@H](C1=CC(=O)c2c(C1=O)c(O)ccc2O)CC=C(C)C
Alias:

1,4-Naphthalenedione, 2-[(1R)-1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-;

1,4-Naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-, (R)-;

1,4-Naphthoquinone, 5,8-dihydroxy-2-(1-hydroxy-4-methyl-3-pentenyl)-, 2-acetate, (+)-;

2-[(1R)-1-(Acetyloxy)-4-methyl-3-penten-1-yl]-5,8-dihydroxy-1,4-naphthalenedione;

(R)-1-(5,8-Dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-en-1-yl acetate;

Acetylshikonin;

NSC 110199
Structure:

Related Targets  (Total: 1)

Target idProtein NameGene SymbolUniprot IDTarget LevelNo.of Literature Evidence
T52XO3 Cytochrome P450 2J2CYP2J2 P51589
A 1 Reference(s)

*In this table, target level represents the quality confidence indicators of targets.
Level 'A' represents "Directly inhibit/activate".
Level 'B' represents "Indirectly inhibit/ activate", "Enzyme substate" and "Enzyme product".
Level 'C' represents "Up/Down regulation" and "Others".

Related Herbs  (Total: 2)

Herb idChinese Pin YinChinese CharacterEnglish NameLatin Name
H0844 Zi Cao紫草 Redroot gromwellLithospermum erythrorhizon
H0673 Xin Jiang Zi Cao新疆紫草 Arnebia rootArnebia euchroma