Hydrochloric Acid → HCID 178443681, compound

HRID 91991Notes

Reaction equation

HRID 91991 reaction equation
[C:28]([CH3:29])([CH3:30])([CH3:31])[O:32][C:33](=[O:34])[NH:35][CH:36]([C:37](=[O:38])[OH:39])[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH:45]=[CH2:46].[CH:47]([N:48]([CH2:49][CH3:50])[CH:51]([CH3:52])[CH3:53])([CH3:54])[CH3:55].[Cl:56][CH2:57][Cl:58].[ClH:27].[c:1]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:2][cH:3][c:4]([C:7]2([S:16][CH2:17][CH2:18][CH2:19][CH3:20])[CH2:8][CH:9]([C:12](=[O:13])[O:14][CH3:15])[NH:10][CH2:11]2)[cH:5][cH:6]1>>[c:1]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:2][cH:3][c:4]([C:7]2([S:16][CH2:17][CH2:18][CH2:19][CH3:20])[CH2:8][CH:9]([C:12](=[O:13])[O:14][CH3:15])[N:10]([C:37]([CH:36]([NH:35][C:33]([O:32][C:28]([CH3:29])([CH3:30])[CH3:31])=[O:34])[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH:45]=[CH2:46])=[O:38])[CH2:11]2)[cH:5][cH:6]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 222502222-((tert-Butoxycarbonyl)amino)non-8-enoic acidHCID 67030398Methyl 4-butylsulfanyl-4-(4-phenylphenyl)pyrrolidine-2-carboxylate

Product 1

HCID 178443681HCID 178443681, compound

Sources & evidence

ORD record
ord-2dee51d1683c4d4baa078455afbb98fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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