Acetic Acid → HCID 178499774, compound

HRID 700114Notes

Reaction equation

HRID 700114 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[O:12][CH3:13])[CH2:14][c:15]1[cH:16][c:17]([Cl:33])[c:18]([C:21]2=[CH:22][C:23](=[O:32])[N:24]([C:28]([CH3:29])([CH3:30])[CH3:31])[S:25]2(=[O:26])=[O:27])[cH:19][cH:20]1.[CH3:34][C:35](=[O:36])[OH:37].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[O:12][CH3:13])[CH2:14][c:15]1[cH:16][c:17]([Cl:33])[c:18]([CH:21]2[CH2:22][C:23](=[O:32])[N:24]([C:28]([CH3:29])([CH3:30])[CH3:31])[S:25]2(=[O:26])=[O:27])[cH:19][cH:20]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 178499773HCID 178499773, compound

Product 1

HCID 178499774HCID 178499774, compound

Sources & evidence

ORD record
ord-3d25566d53e3499992036dc1160d5d5c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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