HCID 9908445, 화합물 → HCID 178485257, 화합물

HRID 315592노트

반응식

HRID 315592 반응식
[S:1]([NH2:2])([O:3][c:4]1[cH:5][c:6]2[c:19]([cH:20][cH:21]1)[CH:18]1[CH:9]([CH2:8][CH2:7]2)[CH:10]2[CH2:11][CH2:12][CH:13]([C:22]([NH:23][CH2:24][CH2:25][CH3:26])=[O:27])[C:14]2([CH3:15])[CH2:16][CH2:17]1)(=[O:28])=[O:29].[S:30](=[O:31])(=[O:32])([O:33][c:34]1[cH:35][cH:36][c:37]2[c:54]([cH:55]1)[CH2:53][CH2:52][CH:39]1[CH:38]2[CH2:43][CH2:42][C:41]2([CH3:44])[CH:40]1[CH2:51][CH:50]=[C:45]2[C:46](=[O:47])[NH:48][CH3:49])[NH2:56]>>[S:1]([NH2:2])([O:3][c:4]1[cH:5][c:6]2[c:19]([cH:20][cH:21]1)[CH:18]1[CH:9]([CH2:8][CH2:7]2)[CH:10]2[CH2:11][CH2:12][CH:13]([C:22]([NH:23][CH3:24])=[O:27])[C:14]2([CH3:15])[CH2:16][CH2:17]1)(=[O:28])=[O:29]

참가 물질

3

출처 및 근거

ORD 기록
ord-6b65ef939b78451ba3d21a18ec84596e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

반응 노트

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