Bicarbonate Ion → HCID 178503687, compound

HRID 205997Notes

Reaction equation

HRID 205997 reaction equation
[C:39](=[O:40])([OH:41])[O-:42].[CH2:51]([Cl:52])[Cl:53].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Na+:43].[Na+:49].[Na+:50].[O:1]1[CH2:2][CH2:3][N:4]([CH2:7][c:8]2[cH:9][cH:10][c:11]([C:14](=[O:15])[NH:16][C:17]3([C:23](=[O:24])[NH:25][CH:26]([CH2:27][CH2:28][S:29][CH3:30])[CH2:31][OH:32])[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]3)[cH:12][cH:13]2)[CH2:5][CH2:6]1.[S:44]([O-:45])([O-:46])(=[O:47])=[S:48]>>[O:1]1[CH2:2][CH2:3][N:4]([CH2:7][c:8]2[cH:9][cH:10][c:11]([C:14](=[O:15])[NH:16][C:17]3([C:23](=[O:24])[NH:25][CH:26]([CH2:27][CH2:28][S:29][CH3:30])[CH:31]=[O:32])[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]3)[cH:12][cH:13]2)[CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ion3×HCID 1084Thiosulfate ionHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 178503688HCID 178503688, compound

Product 1

HCID 178503687HCID 178503687, compound

Sources & evidence

ORD record
ord-50ffc1c3189244439b6ebd180830add1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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