Methanol → HCID 68415654, compound

HRID 1234325Notes

Reaction equation

HRID 1234325 reaction equation
[BH4-:46].[CH2:31]([O:32][C:33]([Cl:34])=[O:35])[CH:36]([CH3:37])[CH3:38].[CH3:39][N:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[CH3:53][OH:54].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[NH2:1][c:2]1[n:3][c:4]2[cH:22][c:20]([n:21]1)[S:19][CH2:18][CH2:17][C:16](=[O:23])[NH:15][CH2:14][CH2:13][CH:12]([C:24](=[O:25])[OH:26])[NH:11][C:10](=[O:27])[c:9]1[c:8]([CH3:29])[cH:7][c:6]([CH3:30])[c:5]-2[cH:28]1.[Na+:47].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1>>[NH2:1][c:2]1[n:3][c:4]2[cH:22][c:20]([n:21]1)[S:19][CH2:18][CH2:17][C:16](=[O:23])[NH:15][CH2:14][CH2:13][CH:12]([CH2:24][OH:25])[NH:11][C:10](=[O:27])[c:9]1[c:8]([CH3:29])[cH:7][c:6]([CH3:30])[c:5]-2[cH:28]1

Participants

9

Reactant 8

HCID 887MethanolHCID 923Sodium ionHCID 79724-MethylmorpholineHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28123BorohydrideHCID 62365Isobutyl chloroformateHCID 68416185HCID 68416185, compound

Product 1

HCID 68415654HCID 68415654, compound

Sources & evidence

ORD record
ord-331afe5b45b9425499491637e4434086
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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