| Identification | Back Directory | [Name]
ISOBUTYRYLSHIKONIN | [CAS]
52438-12-7 | [Synonyms]
Isobutylshikonin
ISOBUTYRYLSHIKONIN
Isobutyroylshikonin
5,8-DIHYDROXY-2-(1-ISOBUTYRYLOXY-4-METHYL-3-PENTENYL)-1,4-NAPHTHALENEDIONE
2-[1-(Isobutyryloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-1,4-naphthoquinone
(R)-1-(1,4-Dihydro-5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methyl-3-pentenyl=isobutyrate
(R)-2-Methyl-propanoic acid 1-(1,4-dihydro-5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)-4-methyl-3-pentenyl ester
2-Methylpropanoic acid (R)-1-[(1,4-dioxo-5,8-dihydroxy-1,4-dihydronaphthalene)-2-yl]-4-methyl-3-pentenyl ester
Propanoic acid, 2-methyl-, (1R)-1-(1,4-dihydro-5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)-4-methyl-3-penten-1-yl ester | [EINECS(EC#)]
932-567-3 | [Molecular Formula]
C20H22O6 | [MDL Number]
MFCD00144512 | [MOL File]
52438-12-7.mol | [Molecular Weight]
358.39 |
| Chemical Properties | Back Directory | [Melting point ]
88 °C | [Boiling point ]
561.9±50.0 °C(Predicted) | [density ]
1.269±0.06 g/cm3(Predicted) | [solubility ]
Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. | [form ]
Powder | [pka]
7.05±0.20(Predicted) | [color ]
Brown to black | [LogP]
3.563 (est) |
| Hazard Information | Back Directory | [Chemical Properties]
Soluble in organic solvents such as methanol, ethanol, and DMSO. | [Uses]
Isobutylshikonin is a kind of shikonin pigments from hairy root culture of Lithospermum canescens[1]. | [Definition]
ChEBI: Isobutylshikonin is a hydroxy-1,4-naphthoquinone. | [References]
[1] H Damianakos, et al. Shikonin pigments from hairy root culture of Lithospermum canescens. Planta Med 2007; 73 - P_185. |
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