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Hydrochloric Acid → 2-hydroxy-N-[1-(7-phenylmethoxy-1H-indol-3-yl)propan-2-yl]-2-pyridin-3-ylacetamide

HRID 1233206
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HRID 1233206 반응식
[C:72](=[O:73])([O-:74])[OH:75].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][cH:12][c:13]2[c:14]([CH2:18][CH:19]([CH3:20])[NH2:21])[cH:15][nH:16][c:17]12.[CH2:46]([N:47]=[C:48]=[N:49][CH2:50][CH2:51][CH2:52][N:53]([CH3:54])[CH3:55])[CH3:56].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[ClH:45].[Na+:76].[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1.[OH2:77].[OH:27][CH:28]([C:29](=[O:30])[OH:31])[c:32]1[cH:33][n:34][cH:35][cH:36][cH:37]1.[OH:57][n:58]1[c:59]2[cH:60][cH:61][cH:62][cH:63][c:64]2[n:65][n:66]1.[S:22]([OH:23])([OH:24])(=[O:25])=[O:26]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][cH:12][c:13]2[c:14]([CH2:18][CH:19]([CH3:20])[NH:21][C:29]([CH:28]([OH:27])[c:32]3[cH:33][n:34][cH:35][cH:36][cH:37]3)=[O:30])[cH:15][nH:16][c:17]12
참가 물질출처 및 근거반응 노트

참가 물질

12

반응물 11

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 1118Sulfuric AcidHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide
HCID 757711-Hydroxybenzotriazole
HCID 111501987-benzyloxy-3-(2-aminopropyl)-1H-indole
HCID 13672728alpha-Hydroxypyridine-3-acetic acid

생성물 1

HCID 1784396162-hydroxy-N-[1-(7-phenylmethoxy-1H-indol-3-yl)propan-2-yl]-2-pyridin-3-ylacetamide

출처 및 근거

ORD 기록
ord-01f86f6841d04c0c9ec1a9e07154322c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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