Water → HCID 178431341, compound

HRID 2332815Notes

Reaction equation

HRID 2332815 reaction equation
[BH3:32].[CH3:1][C:2]1([CH3:28])[O:3][CH2:4][c:5]2[c:6]([cH:8][cH:9][c:10]([CH:12]([C:13](=[O:14])[NH:15][CH:16]3[CH2:17][c:18]4[cH:19][c:20]([OH:26])[cH:21][cH:22][c:23]4[CH2:24][CH2:25]3)[OH:27])[cH:11]2)[O:7]1.[CH3:29][S:30][CH3:31].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH2:43].[OH:33][CH2:34][CH2:35][N:36]([CH2:37][CH2:38][OH:39])[CH2:40][CH2:41][OH:42]>>[CH3:1][C:2]1([CH3:28])[O:3][CH2:4][c:5]2[c:6]([cH:8][cH:9][c:10]([CH:12]([CH2:13][NH:15][CH:16]3[CH2:17][c:18]4[cH:19][c:20]([OH:26])[cH:21][cH:22][c:23]4[CH2:24][CH2:25]3)[OH:27])[cH:11]2)[O:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 1068Dimethyl SulfideHCID 6331BoraneHCID 7618TriethanolamineHCID 8028TetrahydrofuranHCID 178431363HCID 178431363, compound

Product 1

HCID 178431341HCID 178431341, compound

Sources & evidence

ORD record
ord-1160555479b54b60bff81423a6b54df2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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