Sodium ion → HCID 54070291, compound

HRID 311116Notes

Reaction equation

HRID 311116 reaction equation
[C:35]([CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41])(=[O:42])[Cl:43].[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:14]([cH:15][cH:16]1)[S:13][c:12]1[c:7]([cH:8][cH:9][cH:10][c:11]1[S:17]([N:18]([CH3:19])[CH3:20])(=[O:21])=[O:22])[N:6]2[CH2:23][CH2:24][CH2:25][N:26]1[CH2:27][CH2:28][CH:29]([CH2:32][CH2:33][OH:34])[CH2:30][CH2:31]1.[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Na+:50].[Na+:51].[O-:52][C:53](=[O:54])[O-:55].[OH2:63]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:14]([cH:15][cH:16]1)[S:13][c:12]1[c:7]([cH:8][cH:9][cH:10][c:11]1[S:17]([N:18]([CH3:19])[CH3:20])(=[O:21])=[O:22])[N:6]2[CH2:23][CH2:24][CH2:25][N:26]1[CH2:27][CH2:28][CH:29]([CH2:32][CH2:33][O:34][C:35]([CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41])=[O:42])[CH2:30][CH2:31]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962WaterHCID 1140TolueneHCID 8857Ethyl AcetateHCID 17313Heptanoyl chlorideHCID 19660Carbonate IonHCID 21534830HCID 21534830, compound

Product 1

HCID 54070291HCID 54070291, compound

Sources & evidence

ORD record
ord-7760a606123c49e4b7725a9a5b02cf20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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