Hexane → HCID 9933828, 화합물

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[CH3:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[C:11]([CH3:34])([CH3:35])[O:12][c:13]3[c:14]2[c:15]([CH3:33])[c:16]([NH:21][C:22]([CH2:23][c:24]2[cH:25][cH:26][c:27]([O:30][CH3:31])[cH:28][cH:29]2)=[O:32])[c:17]([CH3:20])[c:18]3[CH3:19])[cH:8][cH:9]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[C:11]([CH3:34])([CH3:35])[O:12][c:13]3[c:14]2[c:15]([CH3:33])[c:16]([NH:21][CH2:22][CH2:23][c:24]2[cH:25][cH:26][c:27]([O:30][CH3:31])[cH:28][cH:29]2)[c:17]([CH3:20])[c:18]3[CH3:19])[cH:8][cH:9]1

참가 물질

반응물 2

HCID 8058Hexane

HCID 10276991HCID 10276991, 화합물

생성물 1

HCID 9933828HCID 9933828, 화합물

출처 및 근거

ORD 기록: ord-44740cbf5c16411caa8f2535a27eec0c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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