Hydrochloric Acid → HCID 178449113, compound

HRID 1211651Notes

Reaction equation

HRID 1211651 reaction equation
[CH:55]([OH:56])([CH3:57])[CH3:58].[ClH:59].[Na+:54].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([S:11](=[O:12])(=[O:13])[N:14]([CH2:15][CH:16]([CH3:17])[CH3:18])[CH2:19][CH:20]1[CH:21]([CH2:38][c:39]3[cH:40][cH:41][c:42]([O:45][CH2:46][c:47]4[n:48][cH:49][cH:50][cH:51][cH:52]4)[cH:43][cH:44]3)[N:22]([C:27](=[O:28])[O:29][CH:30]3[CH2:31][O:32][CH:33]4[O:34][CH2:35][CH2:36][CH:37]34)[C:23]([CH3:25])([CH3:26])[O:24]1)[cH:10]2.[OH-:53]>>[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([S:11](=[O:12])(=[O:13])[N:14]([CH2:15][CH:16]([CH3:17])[CH3:18])[CH2:19][CH:20]([CH:21]([NH:22][C:27](=[O:28])[O:29][CH:30]1[CH2:31][O:32][CH:33]3[O:34][CH2:35][CH2:36][CH:37]13)[CH2:38][c:39]1[cH:40][cH:41][c:42]([O:45][CH2:46][c:47]3[n:48][cH:49][cH:50][cH:51][cH:52]3)[cH:43][cH:44]1)[OH:24])[cH:10]2

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 3776IsopropanolHCID 178449009HCID 178449009, compound

Product 1

HCID 178449113HCID 178449113, compound

Sources & evidence

ORD record
ord-52ba506412b24921b04d829cd54635d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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