기본 정보
- CAS
68206-99-5- 표준 SMILES
CCCCCCCCCCCCCCCC(=O)OC1C(SC)OC(C(NC(=O)C2CC(CC)CN2C)C(C)Cl)C(O)C1O- InChIKey
LSOHVGOQENSEGU-UHFFFAOYSA-N- 분자식
- C33H61ClN2O6S
- 평균 분자량
- 649.4 g/mol
- 단동위원소 질량
- 648.3938865
이름 및 식별자
- 우선 이름
- Clindamycin B Palmitate
- IUPAC
- [6-[2-chloro-1-[(4-ethyl-1-methylpyrrolidine-2-carbonyl)amino]propyl]-4,5-dihydroxy-2-methylsulfanyloxan-3-yl] hexadecanoate
- 현지명
- 클린다마이신B팔미테이트
- 영어명
- ClindaMycin B PalMitate
- 분자식
- C33H61ClN2O6S
- 분자량
- 649.37
이름 및 동의어
Clindamycin B Palmitate68206-99-5Clindamycin B 2-Palmitate HClorb3214196SCHEMBL2946138668206-99-5(base)(2R,3R,4S,5R,6R)-6-((1S,2S)-2-chloro-1-((2S,4R)-4-ethyl-1-methylpyrrolidine-2-carboxamido)propyl)-4,5-dihydroxy-2-(methylthio)tetrahydro-2H-pyran-3-yl palmitate HCl(2S-trans)-Methyl 7-Chloro-6,7,8-trideoxy-6-[[(4-ethyl-1-methyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-L-threo-a-D-galacto-octopyranoside 2-Hexadecanoate클린다마이신B팔미테이트*Triazolam Impurity 1-d3Impurity I (clindamycin B palmitate)[6-[2-chloro-1-[(4-ethyl-1-methylpyrrolidine-2-carbonyl)amino]propyl]-4,5-dihydroxy-2-methylsulfanyloxan-3-yl] hexadecanoate
이름 더 보기
(2S-trans)-Methyl 7-Chloro-6,7,8-trideoxy-6-[[(4-ethyl-1-methyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-L-threo-α-D-galacto-octopyranoside 2-HexadecanoateL-threo-α-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[[(2S,4R)-4-ethyl-1-methyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-, 2-hexadecanoate(2R,3R,4S,5R,6R)-6-((1S,2S)-2-chloro-1-((2S,4R)-4-ethyl-1-methylpyrrolidine-2-carboxamido)propyl)-4,5-dihydroxy-2-(methylthio)tetrahydro-2H-pyran-3-yl palmitate
물성
구조 계산 물성
- XLogP
- 9.5
- 극성 표면적
- 134 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 22
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 794
물리화학적 성질
- 끓는 점
- 740.5 · 740.5±60.0 °C(Predicted)
- 밀도
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 12.5 · 12.50±0.70(Predicted)
화학 및 산업
응용 분야
용도Clindamycin B Palmitate is an impurity in the synthesis of Clindamycin Palmitate Hydrochloride (C580035), a semi-synthetic antibiotic with high bioavailability. Clindamycin Palmitate is an antibacterial.
공급사24 곳
南京望知星医药科技有限公司18569809817 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
深圳市简一生物科技有限公司0755-84826604 · [email protected]
济南启源生物科技有限公司18766124282; 18766124282 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
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