Hydrochloric Acid → HCID 67164154, compound

HRID 168666Notes

Reaction equation

HRID 168666 reaction equation
[C:1]([O:2][C:3](=[O:4])[c:8]1[c:9]([NH:19][C:20]([CH2:21][CH2:22][CH2:23][CH2:24][C:25](=[O:26])[NH:27][c:28]2[c:29]([C:30](=[O:31])[O-:32])[cH:33][cH:34][cH:35][cH:36]2)=[O:37])[s:10][cH:11][c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)([CH3:5])([CH3:6])[CH3:7].[C:40]([O:41][C:42]([c:43]1[c:44](-[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][s:52][c:53]1[NH:54][C:55](=[O:56])[CH2:57][CH2:58][CH2:59][CH2:60][C:61]([NH:62][c:63]1[cH:64][cH:65][cH:66][cH:67][c:68]1[C:69]([OH:70])=[O:71])=[O:72])=[O:73])([CH3:74])([CH3:75])[CH3:76].[CH2:84]([Cl:85])[Cl:86].[ClH:39].[F:77][C:78]([F:79])([F:80])[C:81]([OH:82])=[O:83].[Na+:38]>>[cH:8]1[c:9]([NH:19][C:20]([CH2:21][CH2:22][CH2:23][CH2:24][C:25](=[O:26])[NH:27][c:28]2[c:29]([C:30](=[O:31])[OH:32])[cH:33][cH:34][cH:35][cH:36]2)=[O:37])[s:10][cH:11][c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 51041422HCID 51041422, compoundHCID 178450626HCID 178450626, compound

Product 1

HCID 67164154HCID 67164154, compound

Sources & evidence

ORD record
ord-5c17824aa7cf4da1a12e90fb6cedc260
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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