Calcium Cation → HCID 68877648, compound

HRID 1126962Notes

Reaction equation

HRID 1126962 reaction equation
[BH4-:44].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[O:13][CH3:14])[cH:15][c:16]([CH:19]([CH2:20][NH:21][C:22]([CH2:23][CH2:24][N:25]2[CH2:26][N:27]([c:30]3[cH:31][cH:32][c:33]([O:36][CH3:37])[cH:34][cH:35]3)[CH:28]=[CH:29]2)([CH3:38])[CH3:39])[OH:40])[cH:17][cH:18]1.[CH3:51][CH2:52][OH:53].[Ca+2:43].[Cl-:41].[Cl-:42].[Na+:45].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([CH2:11][OH:12])[cH:15][c:16]([CH:19]([CH2:20][NH:21][C:22]([CH2:23][CH2:24][N:25]2[CH2:26][N:27]([c:30]3[cH:31][cH:32][c:33]([O:36][CH3:37])[cH:34][cH:35]3)[CH:28]=[CH:29]2)([CH3:38])[CH3:39])[OH:40])[cH:17][cH:18]1

Participants

8

Reactant 7

HCID 271Calcium CationHCID 312Chloride2×HCID 702EthanolHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 28123BorohydrideHCID 68877168HCID 68877168, compound

Product 1

HCID 68877648HCID 68877648, compound

Sources & evidence

ORD record
ord-7aaf4124572b471fa21e15f0927e6006
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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