Ethanol → HCID 66823764, compound

HRID 2330134Notes

Reaction equation

HRID 2330134 reaction equation
[CH3:50][CH2:51][OH:52].[H:43][H:44].[NH2:1][c:2]1[n:3][cH:4][c:5]([C:29]2=[CH:34][CH2:33][N:32]([C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[CH2:31][CH2:30]2)[c:6]2[c:7]1[c:8](-[c:11]1[cH:12][c:13]3[c:17]([cH:18][cH:19]1)[N:16]([C:20]([CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)=[O:28])[CH2:15][CH2:14]3)[cH:9][s:10]2.[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:42]>>[NH2:1][c:2]1[n:3][cH:4][c:5]([CH:29]2[CH2:30][CH2:31][N:32]([C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[CH2:33][CH2:34]2)[c:6]2[c:7]1[c:8](-[c:11]1[cH:12][c:13]3[c:17]([cH:18][cH:19]1)[N:16]([C:20]([CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)=[O:28])[CH2:15][CH2:14]3)[cH:9][s:10]2

Participants

6

Reactant 5

HCID 702EthanolHCID 962WaterHCID 8028TetrahydrofuranHCID 66823627HCID 66823627, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 66823764HCID 66823764, compound

Sources & evidence

ORD record
ord-09519954ddb64a2ea23041b6e6fa1265
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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