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Hydrochloric Acid → Ethyl 1-[6-oxo-6-(2-phenylmethoxycarbonylpyrrolidin-1-yl)hexanoyl]pyrrolidine-2-carboxylate

HRID 144160
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HRID 144160 반응식
[C:1]1(=[O:9])[CH2:2][CH2:3][CH2:4][CH2:5][C:6](=[O:7])[O:8]1.[CH2:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[O:18][C:19]([CH:20]1[NH:21][CH2:22][CH2:23][CH2:24]1)=[O:25].[CH2:55]([CH3:56])[O:57][C:58]([CH:59]1[NH:60][CH2:61][CH2:62][CH2:63]1)=[O:64].[CH3:26][N:27]1[CH2:28][CH2:29][O:30][CH2:31][CH2:32]1.[CH3:44][N:45]([CH3:46])[CH2:47][CH2:48][CH2:49][N:50]=[C:51]=[N:52][CH2:53][CH3:54].[Cl:65][CH2:66][Cl:67].[ClH:10].[ClH:43].[OH:33][n:34]1[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[n:41][n:42]1>>[C:1]([CH2:2][CH2:3][CH2:4][CH2:5][C:6](=[O:7])[N:60]1[CH:59]([C:58]([O:57][CH2:55][CH3:56])=[O:64])[CH2:63][CH2:62][CH2:61]1)(=[O:8])[N:21]1[CH:20]([C:19]([O:18][CH2:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)=[O:25])[CH2:24][CH2:23][CH2:22]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric Acid2회HCID 6344DichloromethaneHCID 79724-MethylmorpholineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 99767Proline benzyl esterHCID 550673Ethyl pyrrolidine-2-carboxylate
HCID 567658
Adipic anhydride

생성물 1

HCID 69461830Ethyl 1-[6-oxo-6-(2-phenylmethoxycarbonylpyrrolidin-1-yl)hexanoyl]pyrrolidine-2-carboxylate

출처 및 근거

ORD 기록
ord-a1b6b7d69128483bb792336a4f3c48fc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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