Products 54984-93-9

CAS 54984-93-9 appears in our catalog under these names: Acetylshikonin, DL-Acetylshikonin. Offered by: Biosynth, MedChemExpress. Available pack sizes: 50mg, 25mg, 100mg, Get quote.

Acetylshikonin
Biosynth
  • size: 50mg, 25mg, 100mg
  • Variants: 3
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DL-Acetylshikonin
MedChemExpress
  • size: Get quote
  • Variants: 1
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Structural formula: {0} (CAS {1})

Acetylshikonin is a hydroxy-1,4-naphthoquinone and an acetate ester.

Source: ChEBI

Identity
Molecular formulaC18H18O6
Molecular weight330.3 g/mol
IUPAC name[1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate
InChIKeyWNFXUXZJJKTDOZ-UHFFFAOYSA-N
SMILESCC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)C)C

Computed by PubChem (NCBI)

Synonyms: DL-Acetylshikonin, Alkannin, monoacetate, ALKANNIN MONOACETATE, AcetylshikoninShikonin, acetyl, orb1222466, orb1680290, WNFXUXZJJKTDOZ-UHFFFAOYSA-, WNFXUXZJJKTDOZ-UHFFFAOYSA-N, s9257, 1,4-Naphthalenedione, 2-(1-(acetyloxy)-4-methyl-3-pentenyl)-5,8-dihydroxy-
Related forms of this compound
[(1R)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate C18H18O6
[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate C18H18O6
Isomers (same molecular formula)
[(2S,3S)-4-benzoyloxy-2,3-dihydroxybutyl] benzoate C18H18O6
dibenzyl (2R,3R)-2,3-dihydroxybutanedioate C18H18O6
methyl 4-[2-(2,4-dimethoxyphenyl)-2-oxoethoxy]benzoate C18H18O6
(4-ethoxyphenyl) 4-ethoxycarbonyloxybenzoate C18H18O6
tris(prop-2-enyl) benzene-1,3,5-tricarboxylate C18H18O6
methyl 2-methoxy-3-(2-methoxy-3-methoxycarbonylphenyl)benzoate C18H18O6
methyl 3-[2-(4-formyl-2-methoxyphenoxy)ethoxy]benzoate C18H18O6
[(2R,3R)-4-benzoyloxy-2,3-dihydroxybutyl] benzoate C18H18O6
diethyl 2,6-dimethylfuro[2,3-f][1]benzofuran-3,7-dicarboxylate C18H18O6
dibenzyl (2S,3S)-2,3-dihydroxybutanedioate C18H18O6