Ethanol → HCID 22565218, 화합물

HRID 175916

반응식

HRID 175916 반응식
[Br:23][c:24]1[c:25]([CH:30]([CH3:31])[CH3:32])[cH:26][cH:27][cH:28][cH:29]1.[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10]([N:14]2[CH:15]([CH:20]([CH3:21])[CH3:22])[CH2:16][NH:17][CH2:18][CH2:19]2)[cH:11][cH:12][cH:13]1.[CH3:61][O:62][CH2:63][CH2:64][O:65][CH3:66].[CH3:67][CH2:68][OH:69].[CH3:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[c:33]1([P:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]2-[c:47]2[cH:48][cH:49][cH:50][cH:51][c:52]2[N:53]([CH3:54])[CH3:55])[cH:56][cH:57][cH:58][cH:59][cH:60]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10]([N:14]2[CH:15]([CH:20]([CH3:21])[CH3:22])[CH2:16][N:17]([c:24]3[c:25]([CH:30]([CH3:31])[CH3:32])[cH:26][cH:27][cH:28][cH:29]3)[CH2:18][CH2:19]2)[cH:11][cH:12][cH:13]1

참가 물질

7

출처 및 근거

ORD 기록
ord-bae6b0b76f234eb282530837b26a11d4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

불러오는 중…