Water → HCID 53893300, compound

HRID 697164Notes

Reaction equation

HRID 697164 reaction equation
[CH2:1]([NH:8][c:2]1[cH:3][c:4]([C:19]([OH:20])=[O:21])[cH:5][c:6]([S:7]([Cl:9])(=[O:10])=[O:11])[c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[CH2:28]([CH2:29][CH2:30][CH3:31])[S:32][c:33]1[cH:34][c:35]([C:36](=[O:37])[OH:38])[cH:39][c:40]([S:48](=[O:49])(=[O:50])[Cl:51])[c:41]1-[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[OH2:52]>>[NH2:8][S:48]([c:40]1[cH:39][c:35]([C:36](=[O:37])[OH:38])[cH:34][c:33]([S:32][CH2:28][CH2:29][CH2:30][CH3:31])[c:41]1-[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)(=[O:49])=[O:50]

Participants

4

Reactant 3

HCID 962WaterHCID 21546866HCID 21546866, compoundHCID 21546892HCID 21546892, compound

Product 1

HCID 53893300HCID 53893300, compound

Sources & evidence

ORD record
ord-dcafbc3b260c409ab5e1e06b9afc1b14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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