Acetic Acid → HCID 178519421, compound

HRID 1567926Notes

Reaction equation

HRID 1567926 reaction equation
[C:36]([OH:37])(=[O:38])[CH3:39].[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH:1]1([NH:10][c:11]2[n:12][cH:13][n:14][c:15]([CH2:17][CH:18]3[CH2:19][CH:20]4[CH:21]([O:22][CH:23]([c:26]5[cH:27][cH:28][c:29]([O:30][CH3:31])[cH:32][cH:33]5)[O:24][CH2:25]4)[CH2:34]3)[cH:16]2)[CH2:2][CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21.[OH2:35]>>[CH:1]1([NH:10][c:11]2[n:12][cH:13][n:14][c:15]([CH2:17][CH:18]3[CH2:19][CH:20]([CH2:25][OH:24])[CH:21]([OH:22])[CH2:34]3)[cH:16]2)[CH2:2][CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 8028TetrahydrofuranHCID 178489183HCID 178489183, compound

Product 1

HCID 178519421HCID 178519421, compound

Sources & evidence

ORD record
ord-0a438162043a4bef93ae915e5539c1b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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