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기본 정보
- CAS
5373-42-2- 표준 SMILES
COc1cc(C[C@H]2c3cc(OC)c(OC)cc3CCN2C)c(Oc2cc3c(cc2OC)-c2c(OC)c(OC)cc4c2[C@H](C3)N(C)CC4)cc1OC- InChIKey
ZCTJIMXXSXQXRI-KYJUHHDHSA-N- 분자식
- C41H48N2O8
- 평균 분자량
- 696.841 g/mol
- 단동위원소 질량
- 696.3410665
이름 및 식별자
- 우선 이름
- Thalicarpine
- IUPAC
- (6aS)-9-(2-{[(1S)-6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-4,5-dimethoxyphenoxy)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline
- 현지명
- 탈리카르핀
- 영어명
- Thalicarpine
- 분자식
- C41H48N2O8
- 분자량
- 696.83
이름 및 동의어
탈리카르핀Nsc68075Aids002681Aids-002681ThalicarpineThaliblastine(6aS)-9-[4,5-Dimethoxy-2-[[(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methylisoquinolin-1-yl]methyl]phenoxy]-5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-4H-dibenzo[de,g]quinoline4H-Dibenzo[de,G]quinoline, 9-[4,5-dimethoxy-2-[[(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]-5,6,6A,7-tetrahydro-1,2,10-trimethoxy-6-methyl-, (6as)-4H-Dibenzo(de,G)quinoline, 9-(4,5-dimethoxy-2-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)phenoxy)-5,6,6A,7-tetrahydro-1,2,10-trimethoxy-6-methyl-, (S-(R*,R*))-
데이터베이스 식별자
- CAS
5373-42-2- PubChem CID
- 21470
- DTXSID
DTXSID90202011- ChEMBL
CHEMBL507100- ChEBI
CHEBI:9509- UNII
- 8X1D791RF6
- Nikkaji
- J7.977D
물성
물리화학적 성질
- 녹는점
- 160 · 160-161°
- 끓는 점
- 701.43 °C · 701.43°C (rough estimate)
- 밀도
- 1.1544 · 1.1544 (rough estimate)
- 굴절률
- 1.467 · 1.4670 (estimate)
- 산도 계수 (pKa)
- 7.62 · 7.62±0.40(Predicted)
화학 및 산업
응용 분야
개요A complex alkaloid, thaliblastine occurs in Thalictrum minus elatum and has been assigned the structure given on the basis of chemical and spectroscopic investigations. The alkaloid has marked antitumour activity but rapid administration of the base causes brachycardia, hypotension and inhibition of respiration in laboratory animals. Slow intravenous injection, however, produces none of these effects. Thaliblastine is cytotoxic to HEF and Sa9 cells in vitro.
공급사3 곳
上海陶术生物科技股份有限公司13564774135 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
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