Ethanol → HCID 178508656, compound

HRID 148766Notes

Reaction equation

HRID 148766 reaction equation
[CH2:45]([OH:46])[CH3:47].[CH2:48]([O:49][C:50](=[O:51])[CH3:52])[CH3:53].[CH3:40][CH2:41][OH:42].[CH3:43][OH:44].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][CH:9]1[CH2:10][O:11]1.[SH:12][c:13]1[n:14]([CH:15]2[CH:16]([OH:17])[CH:18]([OH:19])[CH:20]([CH2:21][OH:22])[O:23]2)[c:24]2[n:25][cH:26][n:27][c:28]([NH2:31])[c:29]2[n:30]1.[n:32]1[c:33]([CH3:34])[cH:35][cH:36][cH:37][c:38]1[CH3:39]>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][CH:9]([CH2:10][S:12][c:13]1[n:14]([CH:15]2[CH:16]([OH:17])[CH:18]([OH:19])[CH:20]([CH2:21][OH:22])[O:23]2)[c:24]2[n:25][cH:26][n:27][c:28]([NH2:31])[c:29]2[n:30]1)[OH:11]

Participants

7

Reactant 6

HCID 702Ethanol2×HCID 887MethanolHCID 79372,6-LutidineHCID 8857Ethyl AcetateHCID 31217Phenyl glycidyl etherHCID 178508657HCID 178508657, compound

Product 1

HCID 178508656HCID 178508656, compound

Sources & evidence

ORD record
ord-9e70aa2b123449e69b1f156c350ff466
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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