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Hydroxide → 2-(2-tert-Butoxy-2-oxoethyl)-6-(3-chloro-4-fluorobenzyl)-4-methoxy-3,5-dioxo-2,3,5,6,7,8-hexahydro-2,6-naphthyridine-1-carboxylic acid

HRID 2157929
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반응식

HRID 2157929 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][n:8]1[c:9]([C:31](=[O:32])[O:33][CH3:34])[c:10]2[c:15]([c:16]([O:19][CH3:20])[c:17]1=[O:18])[C:14](=[O:21])[N:13]([CH2:22][c:23]1[cH:24][c:25]([Cl:30])[c:26]([F:29])[cH:27][cH:28]1)[CH2:12][CH2:11]2)=[O:35].[Li+:38].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:37].[OH2:36].[OH2:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][n:8]1[c:9]([C:31](=[O:32])[OH:33])[c:10]2[c:15]([c:16]([O:19][CH3:20])[c:17]1=[O:18])[C:14](=[O:21])[N:13]([CH2:22][c:23]1[cH:24][c:25]([Cl:30])[c:26]([F:29])[cH:27][cH:28]1)[CH2:12][CH2:11]2)=[O:35]
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참가 물질

6

반응물 5

HCID 961HydroxideHCID 962Water2회HCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 66996943Methyl 2-(2-tert-butoxy-2-oxoethyl)-6-(3-chloro-4-fluorobenzyl)-4-methoxy-3,5-dioxo-2,3,5,6,7,8-hexahydro-2,6-naphthyridine-1-carboxylate

생성물 1

HCID 66996885
2-(2-tert-Butoxy-2-oxoethyl)-6-(3-chloro-4-fluorobenzyl)-4-methoxy-3,5-dioxo-2,3,5,6,7,8-hexahydro-2,6-naphthyridine-1-carboxylic acid

출처 및 근거

ORD 기록
ord-7fea9a31d6af43888c45e84586230f09
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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