Carbonate Ion → HCID 22143521, 화합물

HRID 198500노트

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HRID 198500 반응식
[C:35](=[O:36])([O-:37])[O-:38].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9]([C:11](=[O:12])[N:13]1[CH2:14][CH:15]([O:18][CH3:19])[CH2:16][CH2:17]1)[s:10]2.[Cs+:39].[Cs+:40].[OH:20][c:21]1[cH:22][cH:23][c:24]2[c:25]([s:26][c:27]([CH3:33])[c:28]2[C:29](=[O:30])[O:31][CH3:32])[cH:34]1>>[c:2]1([O:20][c:21]2[cH:22][cH:23][c:24]3[c:25]([s:26][c:27]([CH3:33])[c:28]3[C:29](=[O:30])[O:31][CH3:32])[cH:34]2)[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9]([C:11](=[O:12])[N:13]1[CH2:14][CH:15]([O:18][CH3:19])[CH2:16][CH2:17]1)[s:10]2

참가 물질

5

반응물 4

HCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 22143527(3-Methoxy-pyrrolidin-1-yl)-[7-chloro-thieno[3,2-b]pyridin-2-yl]-methanoneHCID 22143531HCID 22143531, 화합물

생성물 1

HCID 22143521HCID 22143521, 화합물

출처 및 근거

ORD 기록
ord-fa6b482983c740769cf7f685696909f8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

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