Hydrochloric Acid → HCID 9917719, compound

HRID 169019Notes

Reaction equation

[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][c:16]4[cH:17][cH:18][c:19]5[c:20]([n:21]([CH3:47])[c:22]([CH2:24][O:25][c:26]6[cH:27][cH:28][c:29]([CH2:32][CH:33]([C:34](=[O:35])[O:36][CH3:37])[O:38][CH2:39][c:40]7[cH:41][cH:42][c:43]([F:46])[cH:44][cH:45]7)[cH:30][cH:31]6)[n:23]5)[cH:48]4)[cH:49][cH:50]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH3:65][OH:66].[ClH:53].[Na+:52].[Na+:54].[O:60]1[CH2:61][CH2:62][CH2:63][CH2:64]1.[OH-:51].[OH2:59].[OH:55][C:56](=[O:57])[O-:58]>>[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][c:16]4[cH:17][cH:18][c:19]5[c:20]([n:21]([CH3:47])[c:22]([CH2:24][O:25][c:26]6[cH:27][cH:28][c:29]([CH2:32][CH:33]([C:34](=[O:35])[OH:36])[O:38][CH2:39][c:40]7[cH:41][cH:42][c:43]([F:46])[cH:44][cH:45]7)[cH:30][cH:31]6)[n:23]5)[cH:48]4)[cH:49][cH:50]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2

Participants

Reactant 8

HCID 313Hydrochloric Acid

HCID 769Bicarbonate Ion

HCID 8028Tetrahydrofuran

HCID 10233544HCID 10233544, compound

Product 1

HCID 9917719HCID 9917719, compound

Sources & evidence

ORD record: ord-a9d1ac02a2ea43609a78857bc9f93347
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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