Acetic Acid → HCID 178515707, compound

HRID 101159Notes

Reaction equation

HRID 101159 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][N:22]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][O:29][CH2:30][CH2:31][CH2:32][CH2:33][c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[O:47][CH:48]2[CH2:49][CH2:50][CH2:51][CH2:52][O:53]2)[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12.[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:54][C:55](=[O:56])[OH:57].[OH2:63]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][N:22]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][O:29][CH2:30][CH2:31][CH2:32][CH2:33][c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[OH:47])[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 8028TetrahydrofuranHCID 178515639HCID 178515639, compound

Product 1

HCID 178515707HCID 178515707, compound

Sources & evidence

ORD record
ord-8274d76e549c4c2dbb05008902e066dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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