CAS 25420-97-7 2,3,4-Tri-O-trimethylsilyllincomycin (HCID 71752839)

기본 정보

CAS: 25420-97-7
표준 SMILES: CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@@H](C)O)N(C)C1
InChIKey: PKNYTEMTZAKTHT-ZONSCHRUSA-N
분자식: C27H58N2O6SSi3
평균 분자량: 623.1 g/mol
단동위원소 질량: 622.33233835

이름 및 식별자

우선 이름: 2,3,4-Tri-O-trimethylsilyllincomycin
IUPAC: (2S,4R)-N-[(1R,2R)-2-hydroxy-1-[(2R,3S,4S,5R,6R)-6-methylsulfanyl-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide
영어명: Methyl 6,8-Dideoxy-6-[[[(2S,4R)-1-Methyl-4-propyl-2-pyrrolidinyl]carbonyl]aMino]-1-thio-2,3,4-tris-O-(triMethylsilyl)-D-erythro-α-D-galacto-octopyranoside
분자식: C27H58N2O6SSi3
분자량: 623.08

이름 및 동의어

2,3,4-Tri-O-trimethylsilyllincomycin25420-97-7UNII-598XD7Z5W3598XD7Z5W3(2S,4R)-N-[(1R,2R)-2-hydroxy-1-[(2R,3S,4S,5R,6R)-6-methylsulfanyl-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamideD-Erythro-alpha-D-galacto-octopyranoside, methyl 6,8-dideoxy-6-((((2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl)carbonyl)amino)-1-thio-2,3,4-tris-O-(trimethylsilyl)-D-Erythro-D-galacto-octopyranoside, methyl 6,8-dideoxy-6-(1-methyl-4-propyl-L-2-pyrrolidinecarboxamido)-1-thio-2,3,4-tris-O-(trimethylsilyl)-, trans- alpha-Methyl 6,8-Dideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-2,3,4-tris-O-(trimethylsilyl)-D-erythro-alpha-D-galacto-octopyranosideDTXSID00858543PKNYTEMTZAKTHT-ZONSCHRUSA-N2,3,4-Tri-o-trimethylsilyl lincomycinQ27261682

이름 더 보기

Lincomycin Impurity 23Methyl 6,8-Dideoxy-6-[[[(2S,4R)-1-Methyl-4-propyl-2-pyrrolidinyl]carbonyl]aMino]-1-thio-2,3,4-tris-O-(triMethylsilyl)-D-erythro-α-D-galacto-octopyranoside

물성

구조 계산 물성

극성 표면적: 115 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 8
회전 가능 결합 수: 13
무거운 원자 수: 39
형식 전하: 0
복잡도: 791

물리화학적 성질

녹는점: 131 · 131-136oC
끓는 점: 620.4 · 620.4±55.0 °C(Predicted)
밀도: 1.05 · 1.05±0.1 g/cm3(Predicted)
저장 조건: Refrigerator
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 14.2 · 14.20±0.40(Predicted)
물리적 상태: 고체
색상: 하얀색

화학 및 산업

상·하류 제품 정보

하류 제품

Lincomycin

공급사7 곳

安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

凯试(上海)科技有限公司021-50135380 · [email protected]

湖北扬信医药科技有限公司15347293736 · [email protected]

BOC Sciences16314854226; +8616314854226 · [email protected]

艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]

화합물 노트

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2,3,4-Tri-O-trimethylsilyllincomycin