Methanol → HCID 178497056, compound

HRID 2327670Notes

Reaction equation

HRID 2327670 reaction equation
[Br:33][CH2:34][C:35](=[O:36])[NH2:37].[CH3:60][OH:61].[Cl+3:38]([OH:39])([O-:40])([O-:41])[O-:42].[Cl:1][C:2]([CH2:3][O:4][C:5](=[O:6])[NH:7][CH:8]1[CH:9]2[C:10]3([CH3:30])[CH2:11][CH:12]=[CH:13][CH2:14][CH:15]3[CH2:16][CH2:17][CH:18]2[CH:19]2[CH2:20][CH2:21][CH:22]([C:26](=[O:27])[O:28][CH3:29])[C:23]2([CH3:24])[CH2:25]1)([Cl:31])[Cl:32].[Na+:44].[Na+:58].[Na+:59].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH-:43].[OH2:50].[S:51]([S:52]([O-:53])=[O:54])([O-:55])(=[O:56])=[O:57]>>[Cl:1][C:2]([CH2:3][O:4][C:5](=[O:6])[NH:7][CH:8]1[CH:9]2[C:10]3([CH3:30])[CH2:11][CH:12]4[CH:13]([CH2:14][CH:15]3[CH2:16][CH2:17][CH:18]2[CH:19]2[CH2:20][CH2:21][CH:22]([C:26](=[O:27])[O:28][CH3:29])[C:23]2([CH3:24])[CH2:25]1)[O:36]4)([Cl:31])[Cl:32]

Participants

10

Sources & evidence

ORD record
ord-e2e1e9d40aa34e0cbf9a3faf1bdbeced
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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