Water → HCID 178485233, compound

HRID 301850Notes

Reaction equation

HRID 301850 reaction equation
[CH:1]1([c:4]2[cH:5][c:6]3[c:7]([n:8][c:9]2[CH2:10][N:11]([SH:12](=[O:13])=[O:14])[CH2:15][CH2:16][CH2:17][CH:18]([C:19](=[O:20])[OH:21])[CH3:22])[o:23][c:24](-[c:30]2[cH:31][cH:32][c:33]([CH3:36])[cH:34][cH:35]2)[c:25]3[C:26]([NH:27][CH3:28])=[O:29])[CH2:2][CH2:3]1.[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[OH2:58].[P:37](=[O:38])([O:39][CH2:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)([O:47][CH2:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[O:55][CH2:56][Cl:57]>>[CH:1]1([c:4]2[cH:5][c:6]3[c:7]([n:8][c:9]2[CH2:10][N:11]([SH:12](=[O:13])=[O:14])[CH2:15][CH2:16][CH2:17][CH:18]([C:19](=[O:20])[O:21][CH2:56][O:55][P:37](=[O:38])([O:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[O:47][CH2:48][c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[CH3:22])[o:23][c:24](-[c:30]2[cH:31][cH:32][c:33]([CH3:36])[cH:34][cH:35]2)[c:25]3[C:26]([NH:27][CH3:28])=[O:29])[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 962WaterHCID 6228DimethylformamideHCID 11484214Dibenzyl chloromethyl phosphateHCID 178485235HCID 178485235, compound

Product 1

HCID 178485233HCID 178485233, compound

Sources & evidence

ORD record
ord-aebd99f8a49d48aeb5f1b935ac8c02e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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