Cuminaldehyde → HCID 178438860, 화합물

HRID 118071

반응식

HRID 118071 반응식
[CH2:1]([c:2]1[cH:3][cH:4][c:5](-[c:11]2[c:12]([CH2:17][c:18]3[cH:19][c:20]([OH:30])[n:21][c:22](-[c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[n:23]3)[cH:13][cH:14][cH:15][cH:16]2)[cH:6][cH:7]1)[CH:8]([CH3:9])[CH3:10].[CH:31]([CH3:32])([CH3:33])[c:34]1[cH:35][cH:36][c:37]([CH:38]=[O:39])[cH:40][cH:41]1>>[c:11]1(-[c:37]2[cH:36][cH:35][c:34]([CH:31]([CH3:32])[CH3:33])[cH:41][cH:40]2)[c:12]([CH2:17][c:18]2[cH:19][c:20]([OH:30])[n:21][c:22](-[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[n:23]2)[cH:13][cH:14][cH:15][cH:16]1

참가 물질

3

출처 및 근거

ORD 기록
ord-38c79be0cb1c4eb08d320b98a78b222b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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