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Hydrochloric Acid → 2-((8-(Benzyloxy)-5-(6-(tert-butoxycarbonylamino)hexylamino)-1,6-naphthyridine-7-carboxamido)methyl)-5-fluorobenzoic acid

HRID 2341494
Notes
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Reaction equation

HRID 2341494 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:34](=[O:35])[NH:36][CH2:37][c:38]2[c:39]([C:40](=[O:41])[O:42][CH2:43][CH3:44])[cH:45][c:46]([F:49])[cH:47][cH:48]2)[n:11][c:12]([NH:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[c:13]2[cH:14][cH:15][cH:16][n:17][c:18]12.[CH3:53][CH2:54][OH:55].[ClH:52].[Na+:51].[OH-:50]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:34](=[O:35])[NH:36][CH2:37][c:38]2[c:39]([C:40](=[O:41])[OH:42])[cH:45][c:46]([F:49])[cH:47][cH:48]2)[n:11][c:12]([NH:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[c:13]2[cH:14][cH:15][cH:16][n:17][c:18]12
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 68009450Ethyl 2-((8-(benzyloxy)-5-(6-(tert-butoxycarbonylamino)hexylamino)-1,6-naphthyridine-7-carboxamido)methyl)-5-fluorobenzoate

Product 1

HCID 67109701
2-((8-(Benzyloxy)-5-(6-(tert-butoxycarbonylamino)hexylamino)-1,6-naphthyridine-7-carboxamido)methyl)-5-fluorobenzoic acid

Sources & evidence

ORD record
ord-5583847ae724493793cabbb2359cfdf6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes