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Hydrochloric Acid → HCID 58081055, 화합물

HRID 1134600
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HRID 1134600 반응식
[CH2:51]([N:52]=[C:53]=[N:54][CH2:55][CH2:56][CH2:57][N:58]([CH3:59])[CH3:60])[CH3:61].[CH2:9]([CH3:10])[c:11]1[cH:12][c:13]([O:29][c:30]2[cH:31][n:32][c:33]([S:36](=[O:37])(=[O:38])[CH3:39])[cH:34][cH:35]2)[cH:14][c:15]2[cH:16][c:17]([C:20]3=[N:24][CH2:23][CH:22]([CH2:25][C:26](=[O:27])[OH:28])[S:21]3)[nH:18][c:19]12.[CH3:62][N:63]([CH3:64])[CH:65]=[O:66].[CH3:68][CH2:69][N:70]([CH2:71][CH3:72])[CH2:73][CH3:74].[ClH:1].[ClH:50].[OH2:67].[OH:40][n:41]1[c:42]2[cH:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1.[S:2]1(=[O:8])[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1>>[S:2]1(=[O:8])[CH2:3][CH2:4][N:5]([C:26]([CH2:25][CH:22]2[S:21][C:20]([c:17]3[cH:16][c:15]4[cH:14][c:13]([O:29][c:30]5[cH:31][n:32][c:33]([S:36](=[O:37])(=[O:38])[CH3:39])[cH:34][cH:35]5)[cH:12][c:11]([CH2:9][CH3:10])[c:19]4[nH:18]3)=[N:24][CH2:23]2)=[O:27])[CH2:6][CH2:7]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric Acid2회HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 12600299Thiomorpholine 1-oxide
HCID 58081018
HCID 58081018, 화합물

생성물 1

HCID 58081055HCID 58081055, 화합물

출처 및 근거

ORD 기록
ord-1d0ae198b25d4788bc8f7b53d67fdb9f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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