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기본 정보
- CAS
79907-44-1- 표준 SMILES
O=C(O[C@@H]1[C@@H](c2c(O)cc(O)c3c2O[C@H](c2ccc(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)C3)c2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1- InChIKey
KTLUHRSHFRODPS-RIQPQZJCSA-N- 분자식
- C44H34O20
- 평균 분자량
- 882.736 g/mol
- 단동위원소 질량
- 882.16434349
이름 및 식별자
- 우선 이름
- 3,3′-Digalloylprocyanidin B2
- IUPAC
- (2R,2'R,3R,3'R)-2,2'-Bis(3,4-dihydroxyphenyl)-5,5',7,7'-tetrahydroxy-3,3',4,4'-tetrahydro-2H,2'H-[4,8'-bi-1-benzopyran]-3,3'-diyl bis(3,4,5-trihydroxybenzoate)
- 영어명
- [(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-chroman-8-yl]-5,7-dihydroxy-chroman-3-yl] 3,4,5-trihydroxybenzoate
- 분자식
- C44H34O20
- 분자량
- 882.73
이름 및 동의어
Aids082250Aids-082250Procyanidin B2 3,3'-di-O-gallateProanthocyanidin B2 3,3'-o-gallateProcyanidin B2 3,3'-di-O-gallate (>Procyanidin B2 3,3'-di-O-gallate (>80%)(2R,3R)-3-o-Galloylepicatechin-4.beta.,8-[(2R,3R)-3-o-galloylepicatechin](2R,2'R,3R,3'R,4R)-2,2'-bis(3,4-dihydroxyphenyl)-5,5',7,7'-tetrahydroxy-[4,8'-bichroman]-3,3'-diyl bis(3,4,5-trihydroxybenzoate)Benzoic acid, 3,4,5-trihydroxy-, (2R,2'R,3R,3'R,4R)-2,2'-bis(3,4-dihydroxyphenyl)-3,3',4,4'-tetrahydro-5,5',7,7'-tetrahydroxy[4,8'-bi-2H-1-benzopyran]-3,3'-diyl ester[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-chroman-8-yl]-5,7-dihydroxy-chroman-3-yl] 3,4,5-trihydroxybenzoate
데이터베이스 식별자
- CAS
79907-44-1- PubChem CID
- 124016
- DTXSID
DTXSID101000836- ChEMBL
CHEMBL39504- ChEBI
CHEBI:172846
물성
물리화학적 성질
- 녹는점
- 160 °C · >160°C (dec.)
- 끓는 점
- 1211.7 · 1211.7±65.0 °C(Predicted)
- 밀도
- 1.96 · 1.96±0.1 g/cm3(Predicted)
- 저장 조건
- -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
- 용해도
- 아세톤(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 8.38 · 8.38±0.15(Predicted)
- 색상
- 옅은 오렌지색에서 밝은 갈색까지
- 안정성
- 흡습성
화학 및 산업
응용 분야
용도Procyanidin B2 3,3'-di-O-gallate is an important compound whose activity results in the inhibition of growth pertaining to human prostate carcinoma cell lines. Coming from the group of compounds known as flavonoids, Procyanidin B2 3,3'-di-O-gallate shows interesting biological activities relating to various human cancer diseases.
공급사23 곳
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
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