Water → HCID 15225618, compound

HRID 2340240Notes

Reaction equation

HRID 2340240 reaction equation
[CH:11]1([CH:17]([OH:18])[CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]1.[O:44]=[C:45]([O:46][CH2:47][CH3:48])[N:49]=[N:50][C:51]([O:52][CH2:53][CH3:54])=[O:55].[O:57]1[CH2:58][CH2:59][O:60][CH2:61][CH2:62]1.[OH2:56].[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][cH:7][c:8]([OH:9])[cH:10]1.[c:25]1([P:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][cH:7][c:8]([O:9][CH:17]([CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)[CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[cH:10]1

Participants

7

Reactant 6

HCID 962WaterHCID 74203-Hydroxybenzoic AcidHCID 11776TriphenylphosphineHCID 312751,4-DioxaneHCID 78197alpha-CyclohexylcyclohexanemethanolHCID 220568ethyl N-ethoxycarbonyliminocarbamate

Product 1

HCID 15225618HCID 15225618, compound

Sources & evidence

ORD record
ord-0b5f14fdf73644dba255c0afd7e31a8c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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