Trifluoroacetic acid → 3-[(Acetyloxy)methyl]-7-[[2-carboxy-2-(1-pyrryl)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

HRID 2334103Notes

Reaction equation

HRID 2334103 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][C:6]1=[C:7]([C:29](=[O:30])[OH:31])[N:8]2[C:9](=[O:28])[CH:10]([NH:14][C:15]([CH:16]([n:17]3[cH:18][cH:19][cH:20][cH:21]3)[C:22](=[O:23])[O:24][CH2:25][CH3:26])=[O:27])[CH:11]2[S:12][CH2:13]1.[OH:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38]>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][C:6]1=[C:7]([C:29](=[O:30])[OH:31])[N:8]2[C:9](=[O:28])[CH:10]([NH:14][C:15]([CH:16]([n:17]3[cH:18][cH:19][cH:20][cH:21]3)[C:22](=[O:23])[OH:24])=[O:27])[CH:11]2[S:12][CH2:13]1

Participants

3

Reactant 2

HCID 6422Trifluoroacetic acidHCID 706050383-[(Acetyloxy)methyl]-7-[[2-carboethoxy-2-(1-pyrryl)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]-oct-2-ene-2-carboxylic acid

Product 1

HCID 706051763-[(Acetyloxy)methyl]-7-[[2-carboxy-2-(1-pyrryl)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Sources & evidence

ORD record
ord-3b2994f584ae4ce29ed8f5dd48dc898e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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