2',4''-O-Bis(trimethylsilyl)-6-O-methylerythromycin A 9-[O-(1-methoxy-1-methylethyl) Oxime
기본 정보
- CAS
119699-81-9- 표준 SMILES
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O[Si](C)(C)C)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O[Si](C)(C)C)[C@](C)(OC)C[C@@H](C)C(=NOC(C)(C)OC)[C@H](C)[C@@H](O)[C@]1(C)O- InChIKey
SGGANCFJEHZNCI-MBQKUGEXSA-N- 분자식
- C48H94N2O14Si2
- 평균 분자량
- 979.4 g/mol
- 단동위원소 질량
- 978.62435875
이름 및 식별자
- 우선 이름
- 2',4''-O-Bis(trimethylsilyl)-6-O-methylerythromycin A 9-[O-(1-methoxy-1-methylethyl) Oxime
- IUPAC
- (3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-trimethylsilyloxyoxan-2-yl]oxy-14-ethyl-12,13-dihydroxy-7-methoxy-4-[(2R,4R,5S,6S)-4-methoxy-4,6-dimethyl-5-trimethylsilyloxyoxan-2-yl]oxy-10-(2-methoxypropan-2-yloxyimino)-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one
- 영어명
- Erythromycin, 6-O-Methyl-2',4'-Bis-O-(Trimethylsilyl)-, 9-[O-(1-Methoxy-1-Methylethyl)Oxime]
- 분자식
- C48H94N2O14Si2
- 분자량
- 979.44
이름 및 동의어
119699-81-92',4''-O-Bis(trimethylsilyl)-6-O-methylerythromycin A 9-[O-(1- methoxy-1-methylethyl) OximeErythromycin Impurity 64DTXSID30659287(3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-6-({(2S,3R,4S,6R)-4-(Dimethylamino)-6-methyl-3-[(trimethylsilyl)oxy]oxan-2-yl}oxy)-14-ethyl-12,13-dihydroxy-7-methoxy-4-({(2R,4R,5S,6S)-4-methoxy-4,6-dimethyl-5-[(trimethylsilyl)oxy]oxan-2-yl}oxy)-10-{[(2-methoxypropan-2-yl)oxy]imino}-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecan-2-one2 inverted exclamation mark ,4 inverted exclamation mark inverted exclamation mark -O-Bis(trimethylsilyl)-6-O-methylerythromycin A 9-[O-(1- methoxy-1-methylethyl) Oxime2',4''-O-Bis(trimethylsilyl)-6-O-methylerythromycin A 9-[O-(1- methoxy-1-methylethyl) Oxime; Erythromycin, 6-O-methyl-2',4''-bis-O-(trimethylsilyl)-, 9-[O-(1-methoxy-1-methylethyl)oxime]Erythromycin, 6-O-methyl-2a(2),4a(2)a(2)-bis-O-(trimethylsilyl)-, 9-[O-(1-methoxy-1-methylethyl)oxime]Erythromycin Impurity 76-O-Methyl-2',4'-bis-O-(trimethylsilyl)erythromycin 9-[O-(1-methoxy-1-methylethyl)oxime]
물성
구조 계산 물성
- 극성 표면적
- 175 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 15
- 무거운 원자 수
- 66
- 형식 전하
- 0
- 복잡도
- 1,580
물리화학적 성질
- 끓는 점
- 830 · 830.0±75.0 °C(Predicted)
- 밀도
- 1.11 · 1.11
- 산도 계수 (pKa)
- 13.15 · 13.15±0.70(Predicted)
관련 반응
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