Water → HCID 178458975, compound

HRID 672983Notes

Reaction equation

HRID 672983 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]1[CH:6]([O:7][CH2:8][CH:9]=[CH2:10])[O:11][CH:12]([CH2:31][OH:32])[CH:13]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[C:14]1([OH:15])[CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[C:33]([CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])(=[O:41])[Cl:42].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[OH2:43]>>[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]1[CH:6]([O:7][CH2:8][CH:9]=[CH2:10])[O:11][CH:12]([CH2:31][O:32][C:33]([CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])=[O:41])[CH:13]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[C:14]1([OH:15])[CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1

Participants

5

Reactant 4

HCID 962WaterHCID 1140TolueneHCID 8124Octanoyl chlorideHCID 178458971HCID 178458971, compound

Product 1

HCID 178458975HCID 178458975, compound

Sources & evidence

ORD record
ord-25952a2578e24098a667e31519f89d87
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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