기본 정보
- CAS
33538-71-5- 표준 SMILES
CCC(=O)[C@@H](C)[C@@H](O)[C@H](C)C[C@@H](C)[C@H]1OC(=O)C[C@@]2(O)CC=C(C)[C@H](O2)/C(C)=C/CCC[C@@H](O[C@H]2C[C@@H](OC(N)=O)[C@H](O)[C@@H](C)O2)/C=C/[C@H](C)C[C@H]1C- InChIKey
HHQKNFDAEDTRJK-LIOWZGMGSA-N- 분자식
- C41H67NO11
- 평균 분자량
- 750 g/mol
- 단동위원소 질량
- 749.47141195
개요
Venturicidin a is a diterpene lactone.
이름 및 식별자
- 우선 이름
- Venturicidin A
- IUPAC
- [(2R,3R,4R,6R)-3-hydroxy-6-[[(1R,5S,6R,8R,9E,11R,15E,17R)-1-hydroxy-5-[(2R,4R,5S,6S)-5-hydroxy-4,6-dimethyl-7-oxononan-2-yl]-6,8,16,18-tetramethyl-3-oxo-4,21-dioxabicyclo[15.3.1]henicosa-9,15,18-trien-11-yl]oxy]-2-methyloxan-4-yl] carbamate
- 현지명
- 벤츄리시딘A
- 영어명
- VENTURICIDIN A
- 분자식
- C41H67NO11
- 분자량
- 749.97
이름 및 동의어
Venturicidin AVenturicidin B, 3'-carbamate33538-71-546L30W9XBB[(2R,3R,4R,6R)-3-hydroxy-6-[[(1R,5S,6R,8R,9E,11R,15E,17R)-1-hydroxy-5-[(2R,4R,5S,6S)-5-hydroxy-4,6-dimethyl-7-oxononan-2-yl]-6,8,16,18-tetramethyl-3-oxo-4,21-dioxabicyclo[15.3.1]henicosa-9,15,18-trien-11-yl]oxy]-2-methyloxan-4-yl] carbamateDTXSID201317371((2R,3R,4R,6R)-3-hydroxy-6-(((1R,5S,6R,8R,9E,11R,15E,17R)-1-hydroxy-5-((2R,4R,5S,6S)-5-hydroxy-4,6-dimethyl-7-oxononan-2-yl)-6,8,16,18-tetramethyl-3-oxo-4,21-dioxabicyclo(15.3.1)henicosa-9,15,18-trien-11-yl)oxy)-2-methyloxan-4-yl) carbamateRefChem:193932DTXCID701747187251-568-3Venturidicin ACHEMBL4848659
이름 더 보기
벤츄리시딘Aa-130venturicidinb,3’-carbamateHHQKNFDAEDTRJK-WLJINWSWSA-N4,21-Dioxabicyclo[15.3.1]heneicosa-9,15,18-trien-3-one, 11-[[3-O-(aminocarbonyl)-2,6-dideoxy-β-D-arabino-hexopyranosyl]oxy]-1-hydroxy-5-[(1R,3R,4S,5S)-4-hydroxy-1,3,5-trimethyl-6-oxooctyl]-6,8,16,18-tetramethyl-, (1R,5S,6R,8R,9E,11R,15E,17R)-
Aabomycin A1UNII-46L30W9XBBEINECS 251-568-3AA-0368VENTURICIDIN A [MI]SCHEMBL2219808CHEBI:184114HHQKNFDAEDTRJK-LIOWZGMGSA-N
데이터베이스 식별자
- CAS
33538-71-5- PubChem CID
- 10055855
- DTXSID
DTXSID201317371- ChEMBL
CHEMBL4848659- ChEBI
CHEBI:184114- UNII
- 46L30W9XBB
- EC Number
- 251-568-3
물성
구조 계산 물성
- XLogP
- 5
- 극성 표면적
- 184 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 53
- 형식 전하
- 0
- 복잡도
- 1,310
물리화학적 성질
- 녹는점
- 145 · 145-147°; mp 140-142°
- 끓는 점
- 874.9 · 874.9±65.0 °C(Predicted)
- 밀도
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C
- 용해도
- DMF: Soluble; DMSO: Soluble; Ethanol: Soluble; Methanol: Soluble
- 산도 계수 (pKa)
- 11.8 · 11.80±0.70(Predicted)
- 물리적 상태
- 흰색 내지 회백색 고체.
- 색상
- White to off-white
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- rtecs
- YX4556000
- HS 번호
- 2941900000
화학 및 산업
응용 분야
개요Venturicidin A is a macrolide antibiotic isolated from strains of Streptomyces. It is active against fungi in the genus Venturia which cause apple scab, as well as other fungi, but not against higher plants. Venturicidin A is also cytotoxic against trypanosomes (IC50 = 120-540 ng/ml) while being more than 25,000 times less effective against mammalian cells. It inhibits bacterial and mitochondrial ATP synthases.
용도The macrolide antibiotic, Venturicidin A, isolated from a Streptomyces sp., is a potent inhibitor of mitochondrial ATP synthase complex acting on the F0 membrane sector. Venturicidin A was originally isolated as an antifungal agent.
공급사18 곳
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Aladdin Scientific[email protected]
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孟成科技（上海）有限公司400-820-6829 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
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TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
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