Water → HCID 178495233, compound

HRID 142472Notes

Reaction equation

[CH3:63][CH2:64][O:65][CH2:66][CH3:67].[Cl:68][CH2:69][Cl:70].[OH2:71].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16](=[O:17])[N:18]1[CH2:19][CH:20]([C:39]([N:40]([c:41]3[cH:42][cH:43][c:44]4[c:45]([cH:58]3)[N:46]([CH2:53][CH2:54][CH2:55][O:56][CH3:57])[C:47](=[O:52])[C:48]([CH3:50])([CH3:51])[O:49]4)[CH:59]3[CH2:60][CH2:61]3)=[O:62])[CH2:21][CH:22]([NH:24][C:25]([CH:26]([CH:27]([CH3:28])[CH3:29])[CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])=[O:38])[CH2:23]1)[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16](=[O:17])[N:18]1[CH2:19][CH:20]([C:39]([N:40]([c:41]3[cH:42][cH:43][c:44]4[c:45]([cH:58]3)[N:46]([CH2:53][CH2:54][CH2:55][O:56][CH3:57])[C:47](=[O:52])[C:48]([CH3:50])([CH3:51])[O:49]4)[CH:59]3[CH2:60][CH2:61]3)=[O:62])[CH2:21][CH:22]([NH:24][C:25]([CH:26]([CH:27]([CH3:28])[CH3:29])[CH2:30][OH:31])=[O:38])[CH2:23]1)[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1

Participants

Reactant 4

HCID 962Water

HCID 3283Diethyl Ether

HCID 6344Dichloromethane

HCID 178495234HCID 178495234, compound

Product 1

HCID 178495233HCID 178495233, compound

Sources & evidence

ORD record: ord-14e880a035e441e395dbc591728b0086
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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