기본 정보
- CAS
184587-72-2- 표준 SMILES
COc1c(O)cc2oc3cc4c(c(O)c3c(=O)c2c1CC=C(C)C)CC(O)C(C)(C)O4- InChIKey
KCMPFWGUVNEDHW-UHFFFAOYSA-N- 분자식
- C24H26O7
- 평균 분자량
- 426.5 g/mol
- 단동위원소 질량
- 426.16785316
개요
Mangostanol has been reported in Garcinia mangostana and Garcinia with data available.
이름 및 식별자
- 우선 이름
- Mangostanol
- IUPAC
- 3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-enyl)-3,4-dihydropyrano[3,2-b]xanthen-6-one
- 영어명
- Mangostanol
- 분자식
- C24H26O7
- 분자량
- 426.46
이름 및 동의어
MANGOSTANOL184587-72-2(+)-Mangostanol3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-enyl)-3,4-dihydropyrano[3,2-b]xanthen-6-one3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-en-1-yl)-2,3,4,6-tetrahydro-1,11-dioxatetracen-6-one3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-enyl)-3,4-dihydropyrano(3,2-b)xanthen-6-oneRefChem:155634CHEMBL12242502H,6H-Pyrano[3,2-b]xanthen-6-one, 3,4-dihydro-3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-butenyl)-, (+)- (9CI); (+)-3,4-Dihydro-3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-buten-1-yl)-2H,6H-pyrano[3,2-b]xanthen-6-one; (+)-Mangostanol3,5,9-Trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H,6H-pyrano[3,2-b]xanthen-6-oneorb1682163SCHEMBL30662541
이름 더 보기
3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-en-1-yl)-3,4-dihydropyrano[3,2-b]xanthen-6(2H)-one2H,6H-Pyrano[3,2-b]xanthen-6-one,3,4-dihydro-3,5,9-trihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-buten-1-yl)-,(+)-
DTXSID301318291HY-N3324BDBM50325676TN4492AKOS032961774DA-75301FS-10507CS-0023896
물성
구조 계산 물성
- XLogP
- 4.7
- 극성 표면적
- 105 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 715
물리화학적 성질
- 녹는점
- 164 · 164-166 °C
- 끓는 점
- 657.1 · 657.1±55.0 °C(Predicted)
- 밀도
- 1.318 · 1.318±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 6.89 · 6.89±0.60(Predicted)
화학 및 산업
약리 정보
Cellular LocationsMembrane
응용 분야
개요Mangostanol, also known as 3-isomangostin, belongs to the class of organic compounds known as 8-prenylated xanthones. These are organic compounds containing a C5-isoprenoid group linked to a xanthone moiety at the 8-position. Xanthone is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring that carries a ketone group. Mangostanol is considered to be a practically insoluble (in water) and relatively neutral molecule. Within the cell, mangostanol is primarily located in the membrane (predicted from logP). Outside of the human body, mangostanol can be found in fruits and purple mangosteen. This makes mangostanol a potential biomarker for the consumption of these food products.
공급사27 곳
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [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]
上海永叶生物科技有限公司86-021-61559134 15921386130 · [email protected]
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