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Bicarbonate Ion → Ethyl 7-(3-acetylamino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate

HRID 110472
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반응식

HRID 110472 반응식
[C:22]([CH3:23])(=[O:24])[NH:25][CH:26]1[CH2:27][NH:28][CH2:29][CH2:30]1.[C:31](=[O:32])([OH:33])[O-:34].[CH3:36][C:37]#[N:38].[Cl:1][c:2]1[c:3]([F:21])[cH:4][c:5]2[c:6](=[O:20])[c:7]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[cH:8][n:9]([CH:12]3[CH2:13][CH2:14]3)[c:10]2[n:11]1.[Na+:35]>>[c:2]1([N:28]2[CH2:27][CH:26]([NH:25][C:22]([CH3:23])=[O:24])[CH2:30][CH2:29]2)[c:3]([F:21])[cH:4][c:5]2[c:6](=[O:20])[c:7]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[cH:8][n:9]([CH:12]3[CH2:13][CH2:14]3)[c:10]2[n:11]1
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6

반응물 5

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6342AcetonitrileHCID 5227153-AcetamidopyrrolidineHCID 11722954Ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

생성물 1

HCID 13456047Ethyl 7-(3-acetylamino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate

출처 및 근거

ORD 기록
ord-e79d758db8ad459fa78b4dee8dd6d87c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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