Kuwanon C

HCID 5481958CAS 62949-79-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC(C)=CCc1c(-c2ccc(O)cc2O)oc2c(CC=C(C)C)c(O)cc(O)c2c1=O
InChIKey: UWQYBLOHTQWSQD-UHFFFAOYSA-N
분자식: C25H26O6
평균 분자량: 422.5 g/mol
단동위원소 질량: 422.17293855

개요

Mulberrin has been reported in Morus mongolica, Artocarpus gomezianus, and other organisms with data available.

이름 및 식별자

우선 이름: Kuwanon C
IUPAC: 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis(3-methylbut-2-enyl)chromen-4-one
영어명: Mulberrin
분자식: C25H26O6
분자량: 422.47

이름 및 동의어

Mulberrin62949-79-5Kuwanon CNorartocarpin2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis(3-methylbut-2-enyl)chromen-4-oneDTXSID20212148Mul compooundRefChem:924291DTXCID201346392-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-3,8-bis(3-methyl-2-buten-1-yl)-4H-chromen-4-oneKuwanonc2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis(3-methylbut-2-en-1-yl)-4H-chromen-4-one

이름 더 보기

KuwanonMulberrin, 10 mM in DMSOMulberrin (Synonyms: Kuwanon C)3,8-Bis(3-methyl-2-butenyl)-2',4',5,7-tetrahydroxyflavone

Mulberrin (Kuwanon C)CHEMBL5185432-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-3,8-bis(3-methyl-2-butenyl)-4H-1-benzopyran-4-one2-(2,4-Dihydroxy-phenyl)-5,7-dihydroxy-8-((Z)-3-methyl-but-2-enyl)-3-(3-methyl-but-2-enyl)-1-benzopyran-4-oneMFCD20274692Kuwanon C, 4Mulberrin (Standard)Norartocarpin; Kuwanon C

데이터베이스 식별자

CAS: 62949-79-5
PubChem CID: 5481958
DTXSID: DTXSID20212148
ChEMBL: CHEMBL518543
Nikkaji: J18.937E

물성

구조 계산 물성

XLogP: 6.2
극성 표면적: 107 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 6
회전 가능 결합 수: 5
무거운 원자 수: 31
형식 전하: 0
복잡도: 758

실험 및 물리화학적 성질

LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]

Melting Point148 - 150 °C

Physical DescriptionSolid

물리화학적 성질

녹는점: 153 · 153-156 °C
끓는 점: 657.7 · 657.7±55.0 °C(Predicted)
밀도: 1.29 · 1.290±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: 100 mg/mL · DMSO : 100 mg/mL (236.70 mM; Need ultrasonic)
물리적 상태: 가루
산도 계수 (pKa): 6.7 · 6.70±0.40(Predicted)
색상: 노란색
InChI: InChI=1S/C25H26O6/c1-13(2)5-8-17-20(28)12-21(29)22-23(30)18(9-6-14(3)4)24(31-25(17)22)16-10-7-15(26)11-19(16)27/h5-7,10-12,26-29H,8-9H2,1-4H3
InChIKey: UWQYBLOHTQWSQD-UHFFFAOYSA-N
SMILES: C1(C2=CC=C(O)C=C2O)OC2=C(C/C=C(/C)\C)C(O)=CC(O)=C2C(=O)C=1C/C=C(/C)\C

안전 및 규제

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H315

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationSubstances that reduce or suppress INFLAMMATION.

Cellular LocationsMembrane

응용 분야 · 2건

개요Mulberrin (Mul) is a critical component of the traditional Chinese medicine Romulus Mori, which has antioxidant and anti-inflammatory properties. Studies have indicated that Mul promotes Nrf-2/HO-1 signaling to attenuate oxidative damage, inflammation accumulation, and myocardial apoptosis. In addition, Mul confers protection against hepatic fibrosis by improving Nrf2 nuclear translocation[1].

용도Mulberrin is has potential as a hepatoprotective nutraceutical compound. It can also be used for antiviral, antibacterial, and anti-inflammatory properties.

상·하류 제품 정보

상류 원료

Benzoic acid, 2,4-bis(phenylmethoxy)-1-(2-hydroxy-4,6-bis(methoxymethoxy)phenyl)ethanone 2',4',6'-Trihydroxyacetophenone monohydrate 2,4-다이하이드록시벤조 산 메틸알콜 수산화나트륨 물 아세트산 나트륨 무수초산

공급사50 곳

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]

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銘瑞集團有限公司17318633522 · [email protected]

成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]

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