Hydrochloric Acid → HCID 391856, compound

HRID 1142538Notes

Reaction equation

HRID 1142538 reaction equation
[CH2:44]([CH3:45])[O:46][C:47]([CH:48]([NH2:49])[CH2:50][CH2:51][C:52](=[O:53])[O:54][CH2:55][CH3:56])=[O:57].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[ClH:1].[ClH:43].[NH2:2][c:3]1[n:4][c:5]([CH3:25])[c:6]([N:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][cH:18][c:19]([C:20](=[O:21])[OH:22])[cH:23][cH:24]3)[CH2:14][CH2:15]2)[c:7]([NH2:9])[n:8]1.[P:26]([C:27]#[N:28])(=[O:29])([O:30][CH2:31][CH3:32])[O:33][CH2:34][CH3:35]>>[NH2:2][c:3]1[n:4][c:5]([CH3:25])[c:6]([N:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][cH:18][c:19]([C:20](=[O:21])[NH:49][CH:48]([C:47]([O:46][CH2:44][CH3:45])=[O:57])[CH2:50][CH2:51][C:52](=[O:53])[O:54][CH2:55][CH3:56])[cH:23][cH:24]3)[CH2:14][CH2:15]2)[c:7]([NH2:9])[n:8]1

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 8471TriethylamineHCID 76257Diethyl cyanophosphonateHCID 408343Diethyl 2-aminopentanedioateHCID 9840389HCID 9840389, compound

Product 1

HCID 391856HCID 391856, compound

Sources & evidence

ORD record
ord-09d91e41f0e64f8b8c45b62229bc3c20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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