Water → HCID 178496209, compound

HRID 154664Notes

Reaction equation

HRID 154664 reaction equation
[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:50][S:51](=[O:52])(=[O:53])[Cl:54].[CH3:55][O:56][CH2:57][CH2:58][OH:59].[F:1][c:2]1[c:3](-[n:8]2[n:9][n:10][c:11]([C:15](=[O:16])[N:17]([CH:18]3[CH2:19][N:20]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:21][CH:22]([C:24](=[O:25])[N:26]4[CH2:27][CH2:28][O:29][CH2:30][CH2:31]4)[CH2:23]3)[CH2:39][CH:40]([CH3:41])[CH3:42])[c:12]2[CH2:13][OH:14])[cH:4][cH:5][cH:6][cH:7]1.[OH2:65]>>[F:1][c:2]1[c:3](-[n:8]2[n:9][n:10][c:11]([C:15](=[O:16])[N:17]([CH:18]3[CH2:19][N:20]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:21][CH:22]([C:24](=[O:25])[N:26]4[CH2:27][CH2:28][O:29][CH2:30][CH2:31]4)[CH2:23]3)[CH2:39][CH:40]([CH3:41])[CH3:42])[c:12]2[CH2:13][O:14][CH2:58][CH2:57][O:56][CH3:55])[cH:4][cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 80192-MethoxyethanolHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 178449434HCID 178449434, compound

Product 1

HCID 178496209HCID 178496209, compound

Sources & evidence

ORD record
ord-407e5378f3714490b4f92e41255aad9f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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