Sodium ion → HCID 56656504, compound

HRID 157807Notes

Reaction equation

HRID 157807 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[cH:8][n:9][n:10](-[c:17]3[c:18]([CH2:19][O:20][C:21](=[O:22])[CH3:23])[c:24](-[c:28]4[n:29][n:30]([CH3:49])[c:31](=[O:48])[c:32]([NH:34][c:35]5[n:36][cH:37][c:38]([CH2:41][N:42]6[CH2:43][CH:44]([O:46][CH3:47])[CH2:45]6)[cH:39][cH:40]5)[cH:33]4)[cH:25][cH:26][cH:27]3)[c:11](=[O:16])[c:12]2[c:13]([F:15])[cH:14]1.[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[Na+:51].[OH-:50].[OH2:57]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[cH:8][n:9][n:10](-[c:17]3[c:18]([CH2:19][OH:20])[c:24](-[c:28]4[n:29][n:30]([CH3:49])[c:31](=[O:48])[c:32]([NH:34][c:35]5[n:36][cH:37][c:38]([CH2:41][N:42]6[CH2:43][CH:44]([O:46][CH3:47])[CH2:45]6)[cH:39][cH:40]5)[cH:33]4)[cH:25][cH:26][cH:27]3)[c:11](=[O:16])[c:12]2[c:13]([F:15])[cH:14]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 66742743HCID 66742743, compound

Product 1

HCID 56656504HCID 56656504, compound

Sources & evidence

ORD record
ord-02ea97d7cc11461798ea3b174d5a7e60
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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