Methanol → HCID 178521368, compound

HRID 669051Notes

Reaction equation

HRID 669051 reaction equation
[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[CH3:58][OH:59].[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH:9]([c:24]3[cH:25][cH:26][c:27]([O:28][CH2:29][C:30](=[O:31])[NH:32][CH2:33][C:34](=[O:35])[NH:36][CH:37]([CH2:38][c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[C:45](=[O:46])[O:47][CH3:48])[cH:49][cH:50]3)[CH:10]([S:13][CH2:14][C:15](=[O:16])[c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[C:11]2=[O:12])[cH:6][cH:7]1.[OH2:60]>>[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH:9]([c:24]3[cH:25][cH:26][c:27]([O:28][CH2:29][C:30](=[O:31])[NH:32][CH2:33][C:34](=[O:35])[NH:36][CH:37]([CH2:38][c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[C:45](=[O:46])[OH:47])[cH:49][cH:50]3)[CH:10]([S:13][CH2:14][C:15](=[O:16])[c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[C:11]2=[O:12])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 887MethanolHCID 962WaterHCID 8471TriethylamineHCID 178499840HCID 178499840, compound

Product 1

HCID 178521368HCID 178521368, compound

Sources & evidence

ORD record
ord-2fbee4a7e49641b982276f7a667911d5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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