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에고마케톤

Egomaketone

HCID 42978
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
59204-74-9
표준 SMILES
CC(C)=CCC(=O)c1ccoc1
InChIKey
MGIXHQSSTZKVOO-UHFFFAOYSA-N
분자식
C10H12O2
평균 분자량
164.2 g/mol
단동위원소 질량
164.08372962

개요

Egomaketone is an aromatic ketone.

이름 및 식별자

우선 이름
Egomaketone
IUPAC
1-(furan-3-yl)-4-methylpent-3-en-1-one
현지명
에고마케톤
영어명
EGOMAKETONE
분자식
C10H12O2
분자량
164.2

이름 및 동의어

EGOMAKETONE59204-74-91-(furan-3-yl)-4-methylpent-3-en-1-oneEgomacetoneHSDB 34843-Penten-1-one, 1-(3-furanyl)-4-methyl-O37E2Q1R62EGOMACETONE [HSDB]DTXSID902079451-(3-Furanyl)-4-methyl-3-Penten-1-one3-PENTEN-1-ONE, 1-(3-FURYL)-4-METHYL-RefChem:590625
이름 더 보기
에고마케톤
DTXCID401304363Penten1one, 1(3furanyl)4methyl3-(4-methyl-3-pentenoyl)furanegoma ketoneUNII-O37E2Q1R623-Penten-1-one1-(3-Furyl)-4-methyl-3-penten-1-oneCHEBI:180397

데이터베이스 식별자

CAS
59204-74-9
PubChem CID
42978
DTXSID
DTXSID90207945
ChEBI
CHEBI:180397
UNII
O37E2Q1R62
Nikkaji
J11.166J

물성

구조 계산 물성

XLogP
2.7
극성 표면적
30.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
12
형식 전하
0
복잡도
190

실험 및 물리화학적 성질

Chemical ClassesBiological Agents -> Plant Oils and Extracts
SpringerMaterials PropertiesChemical shift
Melting Point17 °C
Physical DescriptionLiquid
Other Experimental PropertiesMINTY SCENT /ESSENTIAL OIL OF PERILLA FRUTESCENS/

물리화학적 성질

냄새
민트 맛
LogP
2.001 · 2.001 (est)

안전 및 규제

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

유해성 정보

Hazards SummaryA potent lung edemagenic in lethal-dose studies of mice; Cattle eating the wild perilla mint may develop acute bovine pulmonary emphysema. [HSDB] Intraperitoneal LD50 (mouse) = 10 mg/kg; [RTECS]
Special Reports · 1건

A REVIEW WITH 26 REFERENCES ON THE PULMONARY TOXICITY OF NATURALLY OCCURRING 3-SUBSTITUTED FURANS, INCLUDING THE PERILLA FRUTESCENS LUNG TOXIN EGOMAKETONE.[WILSON BJ ET AL; PULMONARY TOXICITY OF NATURALLY OCCURRING 3-SUBSTITUTED FURANS; EFF POISONOUS PLANTS LIVEST (PROC JT US AUST SYMP POISONOUS PLANTS) 311 (1978)]

독성 정보

Natural Pollution SourcesTHE ESSENTIAL OIL OF PERILLA FRUTESCENE CONTAINS AT LEAST THREE POTENT LUNG EDEMAGENIC AGENTS, KNOWN AS PERILLA KETONE, EGOMAKETONE, & ISOEGOMAKETONE, /WHICH HAVE/...STRUCTURAL SIMILARITIES TO SWEET POTATO LUNG TOXINS...
Non-Human Toxicity Excerpts · 5건

TOXICITY STUDIES INDICATE THAT PERILLA KETONE, EGOMAKETONE, & ISOEGOMAKETONE ARE APPROXIMATELY EQUAL IN IP LD50 VALUES & PRODUCE IDENTICAL PULMONARY EFFECTS IN LABORATORY MICE. GROSS PULMONARY LESIONS ARE INDISTINGUISHABLE FROM THE DISEASE CAUSED BY 4-IPOMEANOL; HOWEVER, UNLIKE 4-IPOMEANOL, PERILLA KETONE DOES NOT AFFECT THE KIDNEYS OF ADULT MALE MICE. /PERILLA KETONE/

INJECTIONS OF 3 & 9 MG/KG, RESPECTIVELY, OF PERILLA KETONE DIRECTLY INTO THE RUMEN ELICITED NO RESPONSE IN ANGUS HEIFERS. ANOTHER HEIFER RECEIVING 30 MG/KG IV, HOWEVER, DEVELOPED SEVERE RESPIRATORY DISTRESS BEGINING WITHIN 10 HR & DIED ON THE THIRD DAY AFTER INJECTION. EXTENSIVE PLEURAL EFFUSION WAS PRESENT TOGETHER WITH OTHER PULMONARY DISEASE SIGNS. ANOTHER ANIMAL RECEIVING 40 MG/KG PER OS WAS UNAFFECTED. /PERILLA KETONE/

AN ADULT MALE SHEEP RECEIVING 19 MG/KG OF PERILLA KETONE IV DEVELOPED RESPIRATORY DISTRESS ON DAY 3 BUT HAD IMPROVED SOMEWHAT BY THE FIFTH DAY POSTINJECTION, WHEN IT WAS SACRIFICED. THE LUNGS, AS PRIMARY TARGETS OF THE TOXIN, SHOWED FOCAL CAPILLARY CONGESTION & INTRAALVEOLAR EDEMA. TWO FEMALE GOATS INJECTED IV WITH 18 & 40 MG/KG, RESPECTIVELY, DIED WITHIN 12 HR WITH SEVERE PULMONARY EDEMA. A DOSE OF 10 MG/KG, IV KILLED ANOTHER FEMALE GOAT IN 36 HR. A DOSE OF 150 MG/KG INJECTED INTO THE RUMEN OF A GOAT RESULTED IN DEATH OF THE RECIPIENT IN 48 HR. /PERILLA KETONE/

화학 및 산업

약리 정보

Mechanism of ActionSTUDIES ON THE MECHANISM OF PERILLA KETONE TOXICITY ARE UNDER WAY WHICH, ALTHOUGH INCOMPLETE, SUGGEST THAT WITH FEW EXCEPTIONS, THE MECHANISM OF ITS TOXIC ACTION IS VERY SIMILAR TO THAT OF 4-IPOMEANOL. /PERILLA KETONE/
Cellular LocationsCytoplasm

용도 및 제조

Uses · 2건

Essential oil of perilla frutescene; Used for food flavoring, in soyo folk medicine, and in biochemical and physiological studies; [HSDB]

FOOD FLAVORING; IN "SOYO" FOLK MEDICINE; IN BIOCHEMICAL & PHYSIOLOGICAL STUDIES /ESSENTIAL OIL OF PERILLA FRUTESCENS/

공급사1 곳

北京珐默兹医药科技有限公司15811073878 · [email protected]

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화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트

PONIES INJECTED IV WITH 18 MG OF PERILLA KETONE/KG DEVELOPED A SEVERE RESPIRATORY DISEASE BEGINNING A FEW HR AFTER DOSING WHICH BECAME PROGRESSIVELY MORE SEVERE & ENDED IN DEATH ABOUT 6 HR LATER. THE LUNG LESIONS HISTOLOGICALLY WERE SIMILAR TO THOSE OF ACUTE BOVINE PULMONARY EDEMA (ABPE) IN CATTLE & GOATS. COMPARABLE DOSES OF 4-IPOMEANOL PRODUCED A MUCH MILDER DISEASE, SUGGESTING THAT THIS SPECIES, UNLIKE THE BOVINE, IS MORE SUSCEPTIBLE TO PERILLA KETONE THAN TO THE SWEET POTATO TOXIN. /PERILLA KETONE/

FIELD INVESTIGATIONS.../PROVIDE/ STRONG EVIDENCE THAT WILD PERILLA MINT WAS ANOTHER CAUSE OF EXTENSIVE SEASONAL OUTBREAKS OF THE SYNDROME ACUTE BOVINE PULMONARY EMPHYSEMA (ABPE) IN OKLAHOMA. A REVIEW OF SIMILAR OUTBREAKS IN SEVERAL OTHER STATES...SUGGESTS THAT SUCH OUTBREAKS ARE NOT UNCOMMON, OCCURRING ESPECIALLY IN THE LATE SUMMER OR FALL WHEN NORMAL FORAGE MAY BE SCARCE. /RECENTLY/...OUTBREAKS HAVE BEEN REPORTED IN TENNESSEE FOLLOWING LATE SUMMER DROUGHT. INCRIMINATION OF PERILLA AS A CAUSATIVE AGENT OF ABPE WAS THE RESULT OF FINDING REMNANTS OF PERILLA SEEDS IN THE FORESTOMACHS OR DROPPINGS OF ANIMALS, & NOTING THE TYPICAL PERILLA MINT ODOR UPON OPENING THE GI TRACT AT AUTOPSY. GENERALLY, CATTLE WILL AVOID GRAZING PERILLA UNLESS DRIVEN BY HUNGER WHEN PASTURES ARE LOW. /PERILLA FRUTESCENS/

Non-Human Toxicity Values · 5건

LD50 MICE INTRAPERITONEAL 6 MG/KG MALES /PERILLA KETONE/

LD50 MICE INTRAPERITONEAL 2.5 MG/KG FEMALES /PERILLA KETONE/

LD50 MICE ORAL 16 MG/KG FEMALES /PERILLA KETONE/

LD50 RATS INTRAPERITONEAL 10 MG/KG MALES /PERILLA KETONE/

LD50 RATS ORAL 25 MG/KG MALES /PERILLA KETONE/

안전 데이터

유해 물질 데이터
59204-74-9(Hazardous Substances Data)