Hydrochloric Acid → HCID 178452190, compound

HRID 193360Notes

Reaction equation

HRID 193360 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:33](=[O:34])[N:35]2[CH2:36][S:37][CH2:38][CH2:39]2)[CH2:10][CH:11]([N:13]2[CH2:14][CH2:15][CH:16]([c:19]3[o:20][c:21]4[c:22]([n:23]3)[cH:24][c:25]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:26][cH:27]4)[CH2:17][CH2:18]2)[CH2:12]1.[CH2:40]([O:41][C:42]([c:43]1[cH:44][cH:45][c:46]2[o:47][c:48]([CH:49]3[CH2:50][CH2:51][N:52]([CH:53]4[CH2:54][NH:55][CH:56]([C:57]([N:58]5[CH2:59][CH2:60][S:61][CH2:62]5)=[O:63])[CH2:64]4)[CH2:65][CH2:66]3)[n:67][c:68]2[cH:69]1)=[O:70])[CH3:71].[CH3:75][CH2:76][OH:77].[ClH:79].[Li+:74].[OH-:73].[OH2:72].[OH2:78]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:33](=[O:34])[N:35]2[CH2:36][S:37][CH2:38][CH2:39]2)[CH2:10][CH:11]([N:13]2[CH2:14][CH2:15][CH:16]([c:19]3[o:20][c:21]4[c:22]([n:23]3)[cH:24][c:25]([C:28](=[O:29])[OH:30])[cH:26][cH:27]4)[CH2:17][CH2:18]2)[CH2:12]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 961HydroxideHCID 962Water2×HCID 28486Lithium ionHCID 178468698HCID 178468698, compoundHCID 178468699HCID 178468699, compound

Product 1

HCID 178452190HCID 178452190, compound

Sources & evidence

ORD record
ord-7d03ab029e794eff9c86fc8effb17682
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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