Water → HCID 178447487, compound

HRID 213013Notes

Reaction equation

HRID 213013 reaction equation
[C:22]([CH2:23][CH2:24][CH2:25][CH3:26])(=[O:27])[O:28][CH2:29][C:30]([Cl:31])([Cl:32])[Cl:33].[C:34]([Cl:35])(=[O:36])[CH2:37][CH2:38][CH2:39][CH3:40].[Cl:41][CH2:42][C:43]([Cl:44])([Cl:45])[OH:46].[NH2:1][c:2]1[n:3][c:4]([O:20][CH3:21])[c:5]2[n:6][cH:7][n:8]([CH:11]3[CH:12]([OH:13])[CH:14]([OH:15])[CH:16]([CH2:18][OH:19])[O:17]3)[c:9]2[n:10]1.[OH2:53].[cH:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1>>[NH2:1][c:2]1[n:3][c:4]([O:20][CH3:21])[c:5]2[n:6][cH:7][n:8]([CH:11]3[CH:12]([OH:13])[CH:14]([OH:15])[CH:16]([CH2:18][O:19][C:22]([CH2:23][CH2:24][CH2:25][CH3:26])=[O:27])[O:17]3)[c:9]2[n:10]1

Participants

7

Reactant 6

HCID 962WaterHCID 1049PyridineHCID 61186Valeryl chlorideHCID 2488622-(2-Amino-6-methoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diolHCID 5272642,2,2-Trichloroethyl pentanoateHCID 14671512HCID 14671512, compound

Product 1

HCID 178447487HCID 178447487, compound

Sources & evidence

ORD record
ord-911ef53de62d443a953c425158d95962
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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