Acetic Acid → HCID 178520408, 화합물

HRID 174718노트

반응식

HRID 174718 반응식
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH2:7][CH2:8][CH:9]1[O:10][CH2:11][CH2:12][c:13]2[c:14]1[cH:15][cH:16][c:17]([N:19]=[C:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[cH:18]2)([CH3:5])([CH3:33])[CH3:34].[CH3:51][C:52](=[O:53])[OH:54].[OH:35][CH2:36][CH2:37][CH:38]1[c:39]2[cH:40][cH:41][c:42]([C:43]([NH2:44])=[O:45])[cH:46][c:47]2[CH2:48][CH2:49][O:50]1>>[OH:6][CH2:7][CH2:8][CH:9]1[O:10][CH2:11][CH2:12][c:13]2[c:14]1[cH:15][cH:16][c:17]([N:19]=[C:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[cH:18]2

참가 물질

4

반응물 3

HCID 176Acetic AcidHCID 699044491-(2-Hydroxyethyl)-3,4-dihydro-1H-2-benzopyran-6-carboxamideHCID 178455199HCID 178455199, 화합물

생성물 1

HCID 178520408HCID 178520408, 화합물

출처 및 근거

ORD 기록
ord-227c08836cc94079b87b0c812d001bdc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

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