Hydrochloric Acid → HCID 178471623, compound

HRID 698774

Reaction equation

HRID 698774 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[n:6][c:7]([OH:26])[c:8]2[c:9]([n:10]1)[n:11][cH:12][c:13]([CH:15]=[CH:16][c:17]1[cH:18][cH:19][c:20]([C:23](=[O:24])[OH:25])[cH:21][cH:22]1)[cH:14]2.[CH3:27][N:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[CH3:66][N:67]1[CH2:68][CH2:69][CH2:70][C:71]1=[O:72].[ClH:51].[NH2:52][CH:53]([CH2:54][CH2:55][C:56](=[O:57])[O:58][CH2:59][CH3:60])[C:61](=[O:62])[O:63][CH2:64][CH3:65].[c:34]1([NH:35][P:36]([Cl:37])(=[O:38])[O:39][c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[n:6][c:7]([OH:26])[c:8]2[c:9]([n:10]1)[n:11][cH:12][c:13]([CH:15]=[CH:16][c:17]1[cH:18][cH:19][c:20]([C:23](=[O:24])[NH:52][CH:53]([CH2:54][CH2:55][C:56](=[O:57])[O:58][CH2:59][CH3:60])[C:61](=[O:62])[O:63][CH2:64][CH3:65])[cH:21][cH:22]1)[cH:14]2

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 79724-MethylmorpholineHCID 13387N-methyl-2-pyrrolidoneHCID 103959Phosphoramidochloridic acid, N-phenyl-, phenyl esterHCID 408343Diethyl 2-aminopentanedioateHCID 178474467HCID 178474467, compound

Product 1

HCID 178471623HCID 178471623, compound

Sources & evidence

ORD record
ord-b1a609eea1dd4302a8476bacfdf8d18c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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