(2R,3S,5R)-5-[(1S,2S)-2-Acetylamino-3-(3-fluoro-5-hydroxy-phenyl)-1-hydroxypropyl]-2-(2,2-dimethyl-propoxy)-3-methyl-morpholine-4-carboxylic acid tert-butyl ester

HCID 68560537
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기본 정보

표준 SMILES
CC(=O)N[C@@H](Cc1cc(O)cc(F)c1)[C@H](O)[C@H]1CO[C@@H](OCC(C)(C)C)[C@H](C)N1C(=O)OC(C)(C)C
InChIKey
NIXLONAOAKXCQZ-SIOFMKSISA-N
분자식
C26H41FN2O7
평균 분자량
512.6 g/mol

이름 및 식별자

우선 이름
(2R,3S,5R)-5-[(1S,2S)-2-Acetylamino-3-(3-fluoro-5-hydroxy-phenyl)-1-hydroxypropyl]-2-(2,2-dimethyl-propoxy)-3-methyl-morpholine-4-carboxylic acid tert-butyl ester
IUPAC
tert-butyl (2R,3S,5R)-5-[(1S,2S)-2-acetamido-3-(3-fluoro-5-hydroxyphenyl)-1-hydroxypropyl]-2-(2,2-dimethylpropoxy)-3-methylmorpholine-4-carboxylate

이름 및 동의어

SCHEMBL3236191NIXLONAOAKXCQZ-SIOFMKSISA-N(2R,3S,5R)-5-[(1S,2S)-2-acetylamino-3-(3-fluoro-5-hydroxy-phenyl)-1-hydroxy-propyl]-2-(2,2-dimethyl-propoxy)-3-methyl-morpholine-4-carboxylic acid tert-butyl ester(2R,3S,5R)-5-[(1S,2S)-2-Acetylamino-3-(3-fluoro-5-hydroxy-phenyl)-1-hydroxypropyl]-2-(2,2-dimethyl-propoxy)-3-methyl-morpholine-4-carboxylic acid tert-butyl ester

데이터베이스 식별자

PubChem CID
68560537

물성

구조 계산 물성

XLogP
3.4
극성 표면적
118 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
8
회전 가능 결합 수
10
무거운 원자 수
36

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