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Sodium Ion → Azd-7268

HRID 674012
Notes
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Reaction equation

HRID 674012 reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[Cl:52][CH:53]([Cl:54])[CH3:55].[Cl:56][CH2:57][Cl:58].[Na+:51].[OH:1][CH2:2][CH2:3][N:4]([C:5]([c:6]1[cH:7][cH:8][c:9]([C:12]([c:13]2[cH:14][cH:15][cH:16][c:17]3[cH:18][cH:19][cH:20][n:21][c:22]23)=[C:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:10][cH:11]1)=[O:29])[CH3:30].[s:31]1[cH:32][n:33][c:34]([CH:36]=[O:37])[cH:35]1>>[OH:1][CH2:2][CH2:3][N:4]([C:5]([c:6]1[cH:7][cH:8][c:9]([C:12]([c:13]2[cH:14][cH:15][cH:16][c:17]3[cH:18][cH:19][cH:20][n:21][c:22]23)=[C:23]2[CH2:24][CH2:25][N:26]([CH2:36][c:34]3[n:33][cH:32][s:31][cH:35]3)[CH2:27][CH2:28]2)[cH:10][cH:11]1)=[O:29])[CH3:30]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 923Sodium IonHCID 6344DichloromethaneHCID 63651,1-DichloroethaneHCID 2724942TriacetoxyborohydrideHCID 2763214Thiazole-4-carboxaldehydeHCID 24897669AZD-7268 metabolite M1

Product 1

HCID 24772484
Azd-7268

Sources & evidence

ORD record
ord-ca9a29e6d2074d219258d5d41a42fed6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes