Acetic Acid → HCID 178489392, compound

HRID 1209007

Reaction equation

HRID 1209007 reaction equation
[CH3:42][C:43](=[O:44])[OH:45].[Cl+3:37]([OH:38])([O-:39])([O-:40])[O-:41].[NH2:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8](-[c:12]2[cH:13][c:14]3[c:15]([n:16][cH:17]2)[n:18]([CH2:29][O:30][CH2:31][CH2:32][Si:33]([CH3:34])([CH3:35])[CH3:36])[n:19][c:20]3-[c:21]2[c:22]([O:27][CH3:28])[cH:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]1[CH3:11].[OH2:46]>>[NH2:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8](-[c:12]2[cH:13][c:14]3[c:15]([n:16][cH:17]2)[nH:18][n:19][c:20]3-[c:21]2[c:22]([O:27][CH3:28])[cH:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]1[CH3:11]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 24247Perchloric AcidHCID 579758022-amino-5-[3-(2-methoxy-phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]-3-methyl-benzoic acid

Product 1

HCID 178489392HCID 178489392, compound

Sources & evidence

ORD record
ord-b9825060fda84df482b3c8c458dacb68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Linked notes

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