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기본 정보
- CAS
76996-27-5- 표준 SMILES
CC(C)=CCc1c(O)cc2oc3cc(O)c(O)c(CCC(C)(C)O)c3c(=O)c2c1O- InChIKey
HLOCLVMUASBDDP-UHFFFAOYSA-N- 분자식
- C23H26O7
- 평균 분자량
- 414.454 g/mol
- 단동위원소 질량
- 414.16785317
이름 및 식별자
- 우선 이름
- 1,3,6,7-Tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
- IUPAC
- 1,3,6,7-Tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
- 영어명
- garcinone C
- 분자식
- C23H26O7
- 분자량
- 414.45
이름 및 동의어
garcinone CGarcinone C-RM1,3,6,7-tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methylbut-2-enyl)xanthen-9-one1,3,6,7-tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methylbut-2-enyl)-9H-xanthen-9-one1,3,6,7-Tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one1,3,6,7-Tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one9H-Xanthen-9-one,1,3,6,7-tetrahydroxy-8-(3-hydroxy-3-Methylbutyl)-2-(3-Methyl-2-buten-1-yl)-Cyclin dependent kinase,inhibit,Garcinone C,STAT,ATM/ATR,CDK,ATM and RAD3 related,Inhibitor,Ataxia telangiectasia mutated
데이터베이스 식별자
- CAS
76996-27-5- PubChem CID
- 44159808
- DTXSID
DTXSID60657670- ChEMBL
CHEMBL4440642- ChEBI
CHEBI:175308- Nikkaji
- J2.284.473C
물성
물리화학적 성질
- 끓는 점
- 689 · 689.0±55.0 °C(Predicted)
- 밀도
- 1.367 · 1.367
- 저장 조건
- 4 °C, · 4°C, protect from light
- 용해도
- 80 mg/mL · ≥ 80mg/mL in DMSO
- 산도 계수 (pKa)
- 7.13 · 7.13±0.20(Predicted)
- 물리적 상태
- Solid
- 색상
- Light yellow to yellow
- InChI
- 1S/C23H26O7/c1-11(2)5-6-12-14(24)9-17-19(21(12)27)22(28)18-13(7-8-23(3,4)29)20(26)15(25)10-16(18)30-17/h5,9-10,24-27,29H,6-8H2,1-4H3
- InChIKey
- HLOCLVMUASBDDP-UHFFFAOYSA-N
- SMILES
- OC1=C(CCC(C)(O)C)C2=C(C=C1O)OC3=CC(O)=C(CC=C(C)C)C(O)=C3C2=O
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- WGK 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Garcinone C is isolated from the pericarps of Garcinia mangostana Linn which has multifunctional activities against Alzheimer’s disease (AD). Acetylcholinesterase inhibitor.
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