Hydrochloric Acid → HCID 66900010, compound

HRID 147226Notes

Reaction equation

HRID 147226 reaction equation
[CH3:82][CH2:83][O:84][C:85](=[O:86])[CH3:87].[Cl:1][c:2]1[c:3]([O:4][C:5]2=[CH:6][C:7](=[O:35])[N:8]([CH:10]([C:11](=[O:12])[NH:13][c:14]3[n:15][n:16]([CH2:19][CH:20]4[O:21][C:22]([CH3:25])([CH3:26])[O:23][CH2:24]4)[cH:17][cH:18]3)[CH2:27][c:28]3[c:29]([Cl:34])[cH:30][cH:31][cH:32][cH:33]3)[CH2:9]2)[cH:36][cH:37][cH:38][cH:39]1.[Cl:41][c:42]1[cH:43][cH:44][cH:45][cH:46][c:47]1[O:48][C:49]1=[CH:76][C:74](=[O:75])[N:51]([CH:52]([CH2:53][c:54]2[cH:55][cH:56][c:57]([Cl:58])[cH:59][cH:60]2)[C:61]([NH:62][c:63]2[cH:64][cH:65][n:66]([CH2:67][CH:68]([OH:69])[CH2:70][OH:71])[n:72]2)=[O:73])[CH2:50]1.[ClH:40].[O:77]1[CH2:78][CH2:79][CH2:80][CH2:81]1>>[Cl:1][c:2]1[c:3]([O:4][C:5]2=[CH:6][C:7](=[O:35])[N:8]([CH:10]([C:11](=[O:12])[NH:13][c:14]3[n:15][n:16]([CH2:19][CH:20]([OH:21])[CH2:24][OH:23])[cH:17][cH:18]3)[CH2:27][c:28]3[c:29]([Cl:34])[cH:30][cH:31][cH:32][cH:33]3)[CH2:9]2)[cH:36][cH:37][cH:38][cH:39]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 66899238HCID 66899238, compoundHCID 66899397HCID 66899397, compound

Product 1

HCID 66900010HCID 66900010, compound

Sources & evidence

ORD record
ord-2c054b6c1e044fcf8a82411a8540c66e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…