Hydrochloric Acid → HCID 135469540, compound

HRID 89157Notes

Reaction equation

[CH2:43]1[O:44][CH2:45][CH2:46][O:47][CH2:48]1.[CH3:49][CH2:50][O:51][CH2:52][CH3:53].[ClH:42].[NH2:1][c:2]1[n:3][c:4](-[c:21]2[c:22]([O:37][CH2:38][CH:39]3[CH2:40][CH2:41]3)[cH:23][cH:24][cH:25][c:26]2[O:27][CH2:28][c:29]2[cH:30][cH:31][c:32]([O:33][CH3:34])[cH:35][cH:36]2)[cH:5][c:6](-[c:10]2[cH:11][c:12]([OH:20])[c:13]([NH:16][C:17]([CH3:18])=[O:19])[cH:14][cH:15]2)[c:7]1[CH2:8][OH:9]>>[NH2:1][c:2]1[n:3][c:4](-[c:21]2[c:22]([O:37][CH2:38][CH:39]3[CH2:40][CH2:41]3)[cH:23][cH:24][cH:25][c:26]2[OH:27])[cH:5][c:6](-[c:10]2[cH:11][c:12]([OH:20])[c:13]([NH:16][C:17]([CH3:18])=[O:19])[cH:14][cH:15]2)[c:7]1[CH2:8][OH:9]

Participants

Reactant 4

HCID 313Hydrochloric Acid

HCID 3283Diethyl Ether

HCID 312751,4-Dioxane

HCID 69144971N-{4-[2-amino-6-{2-(cyclopropylmethoxy)-6-[(4-methoxybenzyl)oxy]phenyl}-3-(hydroxymethyl)-4-pyridinyl]-2-hydroxyphenyl}acetamide

Product 1

HCID 135469540HCID 135469540, compound

Sources & evidence

ORD record: ord-5a2c0542ef72488fb7df18c21de13c70
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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