ChemicalBook--->CAS DataBase List--->3568-90-9

3568-90-9

3568-90-9 Structure

3568-90-9 Structure
IdentificationBack Directory
[Name]

deoxylapachol
[CAS]

3568-90-9
[Synonyms]

deoxylapachol
DESOXYLAPACHOL
2-(3-Methyl 2-butenyl)-1,4-naphthoquinone
2-(3-Methyl-2-butenyl)-1,4-naphthoquinone
1,4-Naphthalenedione,2-(3-Methyl-2-buten-1-yl)-
[Molecular Formula]

C15H14O2
[MDL Number]

MFCD04112893
[MOL File]

3568-90-9.mol
[Molecular Weight]

226.27
Chemical PropertiesBack Directory
[solubility ]

Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
[form ]

oil
[color ]

Yellow
[InChI]

InChI=1S/C15H14O2/c1-10(2)7-8-11-9-14(16)12-5-3-4-6-13(12)15(11)17/h3-7,9H,8H2,1-2H3
[Contact allergens]

Deoxylapachol is the main allergen identified in teak (Tectona grandis). Sensitization often concerns people involved in woodwork.
[InChIKey]

OSDFYZPKJKRCRR-UHFFFAOYSA-N
[SMILES]

C1(=O)C2=C(C=CC=C2)C(=O)C=C1C/C=C(/C)\C
[LogP]

4.240 (est)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H300-H315-H319-H335
[Precautionary statements ]

P501-P261-P270-P271-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P310+P330-P304+P340+P312-P403+P233-P405
Hazard InformationBack Directory
[Description]

Deoxylapachol is the main allergen identified in teak (Tectona grandis). Sensitization often concerns people in woodwork.
[Occurrence]

deoxylapachol is a natural product found in?Tectona grandis,?Handroanthus impetiginosus, and?other organisms?with data available.
[Uses]

Deoxylapachol is a major cytotoxic component of New Zealand brown alga,Landsburgia quercifolia. Deoxylapachol has antifungal and anti-cancer activity.
[Definition]

ChEBI: 2-demethylmenaquinone is a naphthoquinone and a member of p-quinones. It has a role as an Escherichia coli metabolite.
[target]

Antifection
Spectrum DetailBack Directory
[Spectrum Detail]

deoxylapachol(3568-90-9)1HNMR
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