기본 정보
- CAS
159407-17-7- 표준 SMILES
c1ccc(CO[C@@H]2[C@H](OCc3ccccc3)[C@@H](Sc3ccccc3)O[C@@H]3CO[C@@H](c4ccccc4)O[C@@H]23)cc1- InChIKey
KDTRYCJSIFGZHI-HOEDGPACSA-N- 분자식
- C33H32O5S
- 평균 분자량
- 540.7 g/mol
이름 및 식별자
- 우선 이름
- (2R,4AR,6R,7S,8S,8aR)-7,8-bis(benzyloxy)-2-phenyl-6-(phenylthio)hexahydropyrano[3,2-d][1,3]dioxine
- IUPAC
- (2R,4aR,6R,7S,8S,8aR)-2-phenyl-7,8-bis(phenylmethoxy)-6-phenylsulfanyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine
- 영어명
- α-D-Mannopyranoside, phenyl 2,3-bis-O-(phenylmethyl)-4,6-O-[(R)-phenylmethylene]-1-thio-
- 분자식
- C33H32O5S
- 분자량
- 540.67
이름 및 동의어
159407-17-7(2R,4AR,6R,7S,8S,8aR)-7,8-bis(benzyloxy)-2-phenyl-6-(phenylthio)hexahydropyrano[3,2-d][1,3]dioxine(2R,4Ar,6R,7S,8S,8aR)-2-phenyl-7,8-bis(phenylmethoxy)-6-phenylsulfanyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxineH85018Phenyl 2,3-di-O-benzyl-4,6-O-benzylidene-1-thio--D-MannopyranosidePhenyl 2,3-di-O-benzyl-4,6-O-benzylidene-1-thio-α-D-MannopyranosidePhenyl 2, 3-Di-O-benzyl-4,6-O-benzylidene-1-thio-α-D-mannopyranosideα-D-Mannopyranoside,phenyl2,3-bis-O-(phenylmethyl)-4,6-O-[(R)-phenylmethylene]-1-thio-a-D-Mannopyranoside, phenyl 2,3-bis-O-(phenylmethyl)-4,6-O-[(R)-phenylmethylene]-1-thio-α-D-Mannopyranoside, phenyl 2,3-bis-O-(phenylmethyl)-4,6-O-[(R)-phenylmethylene]-1-thio-2,3-bis-O-(phenylmethyl)-4,6-O-[(R)-phenylmethylene]-1-thio-α-D--pyranose phenyl phenyl ester
데이터베이스 식별자
- CAS
159407-17-7- Nikkaji
- J1.058.966E
물성
구조 계산 물성
- XLogP
- 6.3
- 극성 표면적
- 71.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 698
물리화학적 성질
- 끓는 점
- 675.3 · 675.3±55.0 °C(Predicted)
- 밀도
- 1.27 · 1.27±0.1 g/cm3(Predicted)
화학 및 산업
공급사8 곳
金瓯生物医药（南京）有限公司13000000000 · [email protected]
济南睿遥明志医疗科技有限公司15662630077 15662630077 · [email protected]
济南山目生物医药科技有限公司0531-88821801 15192360884 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
南京伊派森化学科技有限公司025-58786926 18951781718 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]
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