기본 정보
- CAS
18206-61-6- 표준 SMILES
COc1c(O)cc(C2Oc3c(c(O)cc(O)c3[C@H]3c4c(O)cc(O)cc4O[C@H](c4ccc(O)cc4)[C@@H]3O)C[C@H]2O)cc1O- InChIKey
JPFCOVZKLAXXOE-XBNSMERZSA-N- 분자식
- C31H28O12
- 평균 분자량
- 592.5 g/mol
- 단동위원소 질량
- 592.15807632
개요
Proanthocyanidins has been reported in Paeonia obovata, Humulus lupulus, and other organisms with data available.
이름 및 식별자
- 우선 이름
- Proanthocyanidin
- IUPAC
- (3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
- 현지명
- 포도씨추출물
- 영어명
- GRAPESEEDSEXTRACT
- 분자식
- C31H28O12
- 분자량
- 592.55
이름 및 동의어
Proanthocyanidin(3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol(3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-8-((2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl)-3,4-dihydro-2H-chromene-3,5,7-triolRefChem:929989CHEBI:26267Proanthocyanidin AOuratea proanthocyanidin A274678-42-1CCRIS 9188ZangradoProanthocyanidin, 97%SCHEMBL4747623
이름 더 보기
포도씨추출물GRAPESEEDSEXTRACTPolyhydroxyflavan-3-olProanthocyanidin (grape seed extract)(2R,2R,3R,3R,4R)-2-(3,5-Dihydroxy-4-methoxyphenyl)-2-(4-hydroxyphenyl)-[4,8-bichroman]-3,3,5,5,7,7-hexaol(4,8'-Bi-2H-1-benzopyran)-3,3',5,5',7,7'-hexol, 2'-(3,5-dihydroxy-4-methoxyphenyl)-3,3',4,4'-tetrahydro-2-(4-hydroxyphenyl)-, (2R,2'R,3R,3'R,4R)-
AKOS015967674(4,8'-Bi-2H-1-benzopyran)-3,3',5,5',7,7'-hexol, 2'-(3,5-dihydroxy-4-methoxyphenyl)-3,3',4,4'-tetrahydro-2-(4-hydroxyphenyl)-, (2R-(2alpha,3alpha,4beta(2'R*,3'R*)))-2-(3,5-Dihydroxy-4-methoxyphenyl)-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
물성
구조 계산 물성
- XLogP
- 2.7
- 극성 표면적
- 210 Ų
- 수소 결합 공여자 수
- 9
- 수소 결합 수용자 수
- 12
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 920
물리화학적 성질
- 끓는 점
- 856.6 · 856.6±65.0 °C(Predicted)
- 밀도
- 1.624 · 1.624±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C
- 산도 계수 (pKa)
- 9.2 · 9.20±0.15(Predicted)
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Naturally occurring or synthetic substances that inhibit or retard oxidation reactions. They counteract the damaging effects of oxidation in animal tissues.
Substances that are destructive to protozoans.
공급사2 곳
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
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