Methanol → HCID 178454923, compound

HRID 1537838Notes

Reaction equation

HRID 1537838 reaction equation
[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[CH3:60][OH:61].[Li+:54].[OH-:53].[OH2:52].[OH2:62].[c:1]1(-[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:2][cH:3][c:4]([C:7]2([S:41][CH2:42][CH2:43][CH2:44][CH3:45])[CH2:8][CH:9]3[N:10]([C:11](=[O:39])[CH:12]([NH:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH:18]=[CH:19][CH:20]4[C:21]([C:26](=[O:27])[O:28][CH2:29][CH3:30])([NH:22][C:23]3=[O:24])[CH2:25]4)[CH2:40]2)[cH:5][cH:6]1>>[c:1]1(-[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:2][cH:3][c:4]([C:7]2([S:41][CH2:42][CH2:43][CH2:44][CH3:45])[CH2:8][CH:9]3[N:10]([C:11](=[O:39])[CH:12]([NH:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH:18]=[CH:19][CH:20]4[C:21]([C:26](=[O:27])[OH:28])([NH:22][C:23]3=[O:24])[CH2:25]4)[CH2:40]2)[cH:5][cH:6]1

Participants

7

Reactant 6

HCID 887MethanolHCID 961HydroxideHCID 962Water2×HCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 178454924HCID 178454924, compound

Product 1

HCID 178454923HCID 178454923, compound

Sources & evidence

ORD record
ord-78c6b15a60f14be29406dd9986cc6261
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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