Piperlongumine

HCID 637858CAS 20069-09-4

기본 정보

표준 SMILES
COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC
InChIKey
VABYUUZNAVQNPG-BQYQJAHWSA-N
분자식
C17H19NO5
평균 분자량
317.34 g/mol
단동위원소 질량
317.12632271

개요

Piplartine is a member of cinnamamides and a dicarboximide.

이름 및 식별자

우선 이름
Piperlongumine
IUPAC
1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,3-dihydropyridin-6-one
영어명
PIPERLONGUMINE
분자식
C17H19NO5
분자량
317.34

이름 및 동의어

PiperlonguminePiplartine20069-09-4SGD66V4SVJ1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,3-dihydropyridin-6-one2(1H)-Pyridinone, 5,6-dihydro-1-(1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)-, (E)-1-((E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl)-2,3-dihydropyridin-6-oneRefChem:455155,6-dihydro-1-(1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)-2(1H)pyridinone(E)-1-(3-(3,4,5-trimethoxyphenyl)acryloyl)-5,6-dihydropyridin-2(1H)-oneMFCD000757062(1H)-Pyridinone, 5,6-dihydro-1-[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]-
이름 더 보기
ongPPLGMuminePiperLongumineacryloyl)PIPERLONGUMINPiperlorgumia
1-[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1,2,5,6-tetrahydropyridin-2-oneCHEBI:8241ST079382BRD2293PiplartinBRD-2293(E)-1-[3-(3,4,5-Trimethoxyphenyl)acryloyl]-5,6-dihydropyridin-2(1H)-onePiplartine; (E)-1-(3-(3,4,5-trimethoxyphenyl)acryloyl)-5,6-dihydropyridin-2(1H)-one

데이터베이스 식별자

CAS
20069-09-4
PubChem CID
637858
DTXSID
DTXSID801029762
ChEMBL
CHEMBL465843
ChEBI
CHEBI:8241
UNII
SGD66V4SVJ
EC Number
812-597-2
Nikkaji
J1.741.941B、J14.252B

물성

구조 계산 물성

XLogP
2.1
극성 표면적
65.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
5
무거운 원자 수
23

실험 및 물리화학적 성질

Melting Point124 °C
Physical DescriptionSolid
Collision Cross Section · 2건

174.86 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

176.1 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

물리화학적 성질

녹는점
124 °C · 124°C
끓는 점
475.6 · 475.6±45.0 °C(Predicted)
밀도
1.223 · 1.223±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
용해도
60 °C로 · DMSO: 60°C로 가열 시 ≥5mg/mL
산도 계수 (pKa)
-1.88 · -1.88±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (66.7%)

안전 데이터

wgk
3
rtecs
UU7785850
HS 번호
2932209090
Hazard Classifications
Acute Tox. 4 Oral
스토리지 클래스
11 - Combustible Solids

화학 및 산업

약리 정보

Cellular LocationsCytoplasm
응용 분야 · 3건

개요A piperidinone alkaloid present in Piper longum, the structure has been shown to be N-(3:4:5-trimethoxycinnamoyl)-Lls-piperidin-2-one. In the plant, the base occurs mainly in the roots.

용도Piperlongumine (PL), a new alkaloid abundantly present in Piper longum fruits strongly inhibited platelet cell aggregation. It may have anti-cancer properties. It selectively targets and kills cancer cells but leaving normal cells unharmed.

일반 설명Piperlongumine is an alkaloid, which is extracted from Piper longum Linn. It exhibits anti-atherosclerotic, anxiolytic, antidiabetic, antidepressant, antibacterial, anti-platelet, aggregation, anxiolytic and anti-inflammatory properties. Piperlongumine prevents the production of tumor necrosis factor-α and interleukin-6. It blocks the activation of nuclear factor-κB (NF-κB) against proinflammatory responses. Piperlongumine inhibits plaque formation and inhibits vascular smooth muscle cell migration. It is used to treat cough, respiratory infections and stomach-ache.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
成都埃法生物科技有限公司028-028-85142057 19983342022 · [email protected]

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