Basic information
- CAS
484-29-7- Standard SMILES
COc1c2ccccc2nc2occc12- InChIKey
WIONIXOBNMDJFJ-UHFFFAOYSA-N- Molecular formula
- C12H9NO2
- Average molar mass
- 199.2 g/mol
- Monoisotopic mass
- 199.06332853
Overview
Dictamnine is an organic heterotricyclic compound, an organonitrogen heterocyclic compound, an oxacycle and an alkaloid antibiotic.
Names & identifiers
- Preferred name
- Dictamnine
- IUPAC
- 4-methoxyfuro[2,3-b]quinoline
- English name
- DICTAMNINE
- Molecular formula
- C12H9NO2
- Molecular weight
- 199.21
Names & synonyms
Dictamnine484-29-7Dictamine4-Methoxyfuro[2,3-b]quinolineHQZ3798D0A4-methoxyfuro(2,3-b)quinolineDTXSID0041012RefChem:133189DTXCID8021012Furo[2,3-b]quinoline, 4-methoxy-CCRIS 1583MFCD00221742
Show more names
Dectamine)Dictamnine-RMDictamnine ,98%DICTAMNINE USP/EP/BPDictamine (DictamnineDictamine, 10 mM in DMSO
Dictamnine;DectamineFuro(2,3-b)quinoline, 4-methoxy-BRN 0176932UNII-HQZ3798D0ADiktamininDictamnine; 4-Methoxyfuro[2,3-b]quinoline; Dectamine; DictamineDictamine (Standard)Spectrum_000597
Database identifiers
- CAS
484-29-7- PubChem CID
- 68085
- DTXSID
DTXSID0041012- ChEMBL
CHEMBL22533- ChEBI
CHEBI:4512- UNII
- HQZ3798D0A
- EC Number
- 683-099-9
- Nikkaji
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 234
Experimental & physicochemical properties
Collision Cross Section
135.2 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
133.64 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physicochemical properties
- Melting point
- 133 ° · 133°
- Boiling point
- 336.72 °C · 336.72°C (rough estimate)
- Density
- 1.1919 · 1.1919 (rough estimate)
- refractive index
- 1.588 · 1.5880 (estimate)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- pka
- 7.24 · 7.24±0.40(Predicted)
- color
- Light Beige
- CAS DataBase Reference
- 484 · 484-29-7
- FDA UNII
- 3798 D0A · HQZ3798D0A
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Toxicology
Treatment
Phytophotodermatitis can be prevented by staying indoors after handling dictamnine. Windows will filter out ultraviolet light and prevent symptoms from arising. Many different topical and oral medications can be used to treat the inflammatory reaction of phytophotodermatitis. A dermatologist may also prescribe a bleaching cream to help treat the hyperpigmentation and return the skin pigmentation back to normal. If they do not receive treatment, the affected sites may develop permanent hyperpigmentation or hypo pigmentation. Sunblock can greatly mitigate symptoms, at least when caused by rue (Ruta Graveolens). (Wikipedia)
Health Effects
Dictamnine may play a major role in the elicitation of phytophotodermatitis (A15434). Phytophotodermatitis, also known as "Lime Disease" (not to be confused with Lyme Disease), "Berloque dermatitis", or "Margarita photodermatitis" is a chemical reaction which makes skin hypersensitive to ultraviolet light. It is caused by contact with photosensitizing compounds. (Wikipedia)
Exposure RoutesDermal
Chemistry & industry
Uses & manufacturing
Uses
Dictamnine is the main alkaloid in the roots of Dictamnus albus, and occurs in other plants of the Rutaceae family. Dictamnine has been reported to have antimicrobial activity against bacteria and fungi. Dictamnine has anti-platelet aggregation and vascular-relaxing activities, insecticidal activities, phototoxicity to bacteria and yeast and antibacterial activity against Mycobacterium smegmatis and Bacillus subtilis. Dictamnine has also been widely used to treat certain skin diseases. (A15435)
Applications
Usesantifungal, vasal relaxant, mooth muscle contractant
UsesDictamnine is an herbal extract from the root of Dictamnus dasycarpus, and exhibits anti-microbial activity against bacteria and fungi. Phytotoxic agent.
Suppliers100 total
北京华美互利生物化工010-56205725 · [email protected]
成都普瑞法科技开发有限公司+86-028-82633397 18982077548 · [email protected]
成都曼思特生物科技有限公司18010516991 · [email protected]
南京普怡生物科技有限公司13814510036 · [email protected]
成都埃法生物科技有限公司028-028-85142057 19983342022 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
成都健腾生物技术有限公司028-85159085 18080455027 · [email protected]
成都市久鼎化学技术有限公司
Related reactions
1 records
Compound notes
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