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Dictamnine

HCID 68085
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
484-29-7
표준 SMILES
COc1c2ccccc2nc2occc12
InChIKey
WIONIXOBNMDJFJ-UHFFFAOYSA-N
분자식
C12H9NO2
평균 분자량
199.2 g/mol
단동위원소 질량
199.06332853

개요

Dictamnine is an organic heterotricyclic compound, an organonitrogen heterocyclic compound, an oxacycle and an alkaloid antibiotic.

이름 및 식별자

우선 이름
Dictamnine
IUPAC
4-methoxyfuro[2,3-b]quinoline
영어명
DICTAMNINE
분자식
C12H9NO2
분자량
199.21

이름 및 동의어

Dictamnine484-29-7Dictamine4-Methoxyfuro[2,3-b]quinolineHQZ3798D0A4-methoxyfuro(2,3-b)quinolineDTXSID0041012RefChem:133189DTXCID8021012Furo[2,3-b]quinoline, 4-methoxy-CCRIS 1583MFCD00221742
이름 더 보기
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

데이터베이스 식별자

CAS
484-29-7
PubChem CID
68085
DTXSID
DTXSID0041012
ChEMBL
CHEMBL22533
ChEBI
CHEBI:4512
UNII
HQZ3798D0A
EC Number
683-099-9
Nikkaji
J5.995A

물성

구조 계산 물성

XLogP
2.7
극성 표면적
35.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
15
형식 전하
0
복잡도
234

실험 및 물리화학적 성질

Collision Cross Section · 2건

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]

물리화학적 성질

녹는점
133 ° · 133°
끓는 점
336.72 °C · 336.72°C (rough estimate)
밀도
1.1919 · 1.1919 (rough estimate)
굴절률
1.588 · 1.5880 (estimate)
저장 조건
Inert atmosphere,Room Temperature
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨, 가열)
산도 계수 (pKa)
7.24 · 7.24±0.40(Predicted)
물리적 상태
고체
색상
라이트 베이지

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

독성 정보

Treatment · 1건

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 · 1건

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
Toxicity Summary · 1건

화학 및 산업

용도 및 제조

Uses · 1건

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)

응용 분야

용도Dictamnine is an herbal extract from the root of Dictamnus dasycarpus, and exhibits anti-microbial activity against bacteria and fungi. Phytotoxic agent.

공급사100 곳

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18584079237 · [email protected]

관련 반응

1건
반응 기록 만들기
HRID 353062 반응식
HRID 353062반응물로uspto-grants-2004_06

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트

Dictamnine has been shown to be phototoxic to human cell lines (namely Jurkat T cells and HaCaT keratinocytes). Although it is less phototoxic than the structurally related furocoumarins 5-methoxypsoralen and 8-methoxypsoralen, "it may play a major role in the elicitation of phytophotodermatitis because of its abundance in plants of the Rutaceae family." (A15434)

Signs and Symptoms · 1건

The symptoms are equivalent to photodermatitis, but vary in severity. The skin condition is a cutaneous phototoxic inflammatory eruption resulting from contact with light-sensitizing botanical substances—particularly from the plant families Umbelliferae, Rutaceae, Moraceae, and Leguminosae—and ultraviolet light, typically from sun exposure. Phytophotodermatitis usually results in hyperpigmentation of the skin that often appears like a bruise. This may be accompanied by blisters or burning. The reaction typically begins within 24 hours of exposure and peaks at 48–72 hours after the exposure. (Wikipedia)

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

안전 데이터

신호 어
Warning
유해·위험 문구
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302
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MedBio脉铂医药021-69568360 18916172912 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
贵州迪大科技有限责任公司0851-8475-2296 18096062265 · [email protected]
Aktin Chemicals, Inc.028-85159085 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
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AdooQ BioScience, LLC+1 (866) 930-6790 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
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ALB Technology Limited702-983-3769 · [email protected]
TargetMol中国(陶术生物)021-021-33632979 15002134094 · [email protected]
武汉天植生物技术有限公司18607101326 15172504745 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海皓之翔生物科技有限公司(原上海拓青化工有限公司)526763801 13301653310 · [email protected]
Wuhan ChemNorm Biotech Co.,Ltd.+86-27-8439 4403 18971486879 · [email protected]
上海珞珐生化科技有限公司021-51111890 15317326293 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
广州市齐云生物技术有限公司020-61288194 61288195 · [email protected]
上海西格生物科技有限公司021-57810052 18930344717 · [email protected]
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