Calcium Cation → HCID 57387083, 화합물

HRID 2317347노트

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HRID 2317347 반응식
[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:46][CH2:47][OH:48].[Ca+2:35].[Cl-:33].[Cl-:34].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[c:8]([F:23])[cH:9][cH:10][c:11]([O:13][c:14]3[n:15][cH:16][c:17]([N+:20]([O-:21])=[O:22])[cH:18][cH:19]3)[cH:12]2)[cH:24][cH:25][cH:26][c:27]1[C:28]1([C:31]#[N:32])[CH2:29][CH2:30]1.[Fe:38].[Na+:37].[OH-:36].[OH2:45]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[c:8]([F:23])[cH:9][cH:10][c:11]([O:13][c:14]3[n:15][cH:16][c:17]([NH2:20])[cH:18][cH:19]3)[cH:12]2)[cH:24][cH:25][cH:26][c:27]1[C:28]1([C:31]#[N:32])[CH2:29][CH2:30]1

참가 물질

10

출처 및 근거

ORD 기록
ord-fdce5a5166e34b60ae077117550c1d69
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

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