Hydrochloric Acid → HCID 178451518, compound

HRID 1240400Notes

Reaction equation

HRID 1240400 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[n:11][c:12]([C:17]([O:19][CH3:18])=[O:20])[n:13][cH:14][c:15]2[CH2:16]1.[Cl:24][c:25]1[cH:26][c:27]2[cH:28][c:29]([C:34](=[O:35])[NH:36][CH:37]3[CH:38]([NH2:43])[CH2:39][CH2:40][CH2:41][CH2:42]3)[nH:30][c:31]2[cH:32][cH:33]1.[ClH:23].[Li+:21].[OH-:22]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[n:11][c:12]([C:17](=[O:19])[NH:43][CH:38]3[CH:37]([NH:36][C:34]([c:29]4[cH:28][c:27]5[cH:26][c:25]([Cl:24])[cH:33][cH:32][c:31]5[nH:30]4)=[O:35])[CH2:42][CH2:41][CH2:40][CH2:39]3)[n:13][cH:14][c:15]2[CH2:16]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 28486Lithium ionHCID 184428206-(1,1-Dimethylethyl) 2-methyl 5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-2,6-dicarboxylateHCID 68449716HCID 68449716, compound

Product 1

HCID 178451518HCID 178451518, compound

Sources & evidence

ORD record
ord-a05a88d2e9f7456d8a60dd2850177fca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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