Acetic Acid → HCID 59394261, compound

HRID 1139608Notes

Reaction equation

HRID 1139608 reaction equation
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH2:7][c:8]1[cH:9][c:10]([NH:18][C:19](=[O:20])[n:21]2[cH:22][cH:23][c:24]3[cH:25][c:26]([O:30][c:31]4[c:32]5[c:33]([n:34][cH:35][n:36]4)[CH2:37][N:38]([C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:39][CH2:40]5)[cH:27][cH:28][c:29]23)[cH:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]1)([CH3:5])([CH3:48])[CH3:49].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:56][C:57](=[O:58])[OH:59].[CH3:60][CH2:61][O:62][C:63]([CH3:64])=[O:65].[OH2:55]>>[OH:6][CH2:7][c:8]1[cH:9][c:10]([NH:18][C:19](=[O:20])[n:21]2[cH:22][cH:23][c:24]3[cH:25][c:26]([O:30][c:31]4[c:32]5[c:33]([n:34][cH:35][n:36]4)[CH2:37][N:38]([C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:39][CH2:40]5)[cH:27][cH:28][c:29]23)[cH:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 59394706HCID 59394706, compound

Product 1

HCID 59394261HCID 59394261, compound

Sources & evidence

ORD record
ord-7c3778b1ca0640a99985b7cef1678a56
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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