Acetic Acid → HCID 178525201, compound

HRID 1231681Notes

Reaction equation

HRID 1231681 reaction equation
[C:1](=[O:2])([CH3:3])[S:4][CH:5]1[CH2:6][CH:7]([CH2:23][N:24]2[c:25]3[n:26]([n:30][cH:31][cH:32]3)[CH2:27][CH2:28][CH2:29]2)[N:8]([C:10](=[O:11])[O:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[cH:18][cH:19]2)[CH2:9]1.[CH3:33][O-:34].[CH3:36][C:37](=[O:38])[OH:39].[CH3:40][OH:41].[Na+:35].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[SH:4][CH:5]1[CH2:6][CH:7]([CH2:23][N:24]2[c:25]3[n:26]([n:30][cH:31][cH:32]3)[CH2:27][CH2:28][CH2:29]2)[N:8]([C:10](=[O:11])[O:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[cH:18][cH:19]2)[CH2:9]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 3826051MethoxideHCID 178477011HCID 178477011, compound

Product 1

HCID 178525201HCID 178525201, compound

Sources & evidence

ORD record
ord-64d65b36349441549681dece17f10d40
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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