Water → HCID 22101180, compound

HRID 1214527Notes

Reaction equation

HRID 1214527 reaction equation
[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH2:36][CH3:37])([CH3:38])[CH3:39].[Cl:1][C:2]([Cl:3])([O:4][C:5]([O:6][C:7]([Cl:8])([Cl:9])[Cl:10])=[O:11])[Cl:12].[NH2:13][c:14]1[n:15][n:16]([CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:17][c:18]1[C:19](=[O:20])[O:21][CH2:22][CH3:23].[NH2:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[OH2:52]>>[C:5](=[O:11])([NH:13][c:14]1[n:15][n:16]([CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:17][c:18]1[C:19](=[O:20])[O:21][CH2:22][CH3:23])[NH:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1

Participants

7

Sources & evidence

ORD record
ord-3235ef094c664fb2a6b48a67495fbf61
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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