Bicarbonate Ion → HCID 178510855, compound

HRID 2335811Notes

Reaction equation

HRID 2335811 reaction equation
[C:74](=[O:75])([OH:76])[O-:77].[CH2:79]([Cl:80])[Cl:81].[CH3:65][OH:66].[CH:1]1([CH2:7][CH:8]([CH:9]([CH:10]([OH:11])[CH:12]2[CH2:13][CH2:14]2)[OH:15])[NH:16][C:17]([CH:18]([CH2:19][c:20]2[n:21][cH:22][n:23]([C:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[cH:24]2)[NH:44][C:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)=[O:64])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[K+:78].[OH:67][C:68]([C:69]([F:70])([F:71])[F:72])=[O:73]>>[CH:1]1([CH2:7][CH:8]([CH:9]([CH:10]([OH:11])[CH:12]2[CH2:13][CH2:14]2)[OH:15])[NH:16][C:17]([CH:18]([CH2:19][c:20]2[n:21][cH:22][n:23]([C:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[cH:24]2)[NH2:44])=[O:64])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 813Potassium CationHCID 887MethanolHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 178523169HCID 178523169, compound

Product 1

HCID 178510855HCID 178510855, compound

Sources & evidence

ORD record
ord-2db7f0da885940898971213c7880452c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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