Acetic Acid → HCID 91497007, compound

HRID 311444Notes

Reaction equation

HRID 311444 reaction equation
[CH3:36][C:37](=[O:38])[O:39][C:40](=[O:41])[CH3:42].[CH3:43][C:44](=[O:45])[OH:46].[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH:12]2[CH2:13][CH2:14][N:15]([CH:18]3[CH:19]([c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[CH2:20][CH2:21][CH2:22][CH2:23]3)[CH2:16][CH2:17]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH:12]2[CH2:13][CH2:14][N:15]([CH:18]3[CH:19]([c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[CH2:20][CH2:21][CH2:22][CH2:23]3)[CH2:16][CH2:17]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:6][cH:7]1)[C:37]([CH3:36])=[O:38]

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 7918Acetic AnhydrideHCID 90733028HCID 90733028, compound

Product 1

HCID 91497007HCID 91497007, compound

Sources & evidence

ORD record
ord-4184fb77c5d245babc27fe100017dbd5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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