Hydrochloric Acid → HCID 66673789, compound

HRID 1202712Notes

Reaction equation

HRID 1202712 reaction equation
[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[NH:20][C:21]1([C:36](=[O:37])[OH:38])[CH2:22][CH2:23][N:24]([c:27]2[c:28]3[c:29]([n:30][cH:31][n:32]2)[nH:33][cH:34][cH:35]3)[CH2:25][CH2:26]1.[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[ClH:1].[NH2:2][CH:3]([CH2:4][CH2:5][OH:6])[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[P-:48]([F:49])([F:50])([F:51])([F:52])([F:53])[F:54].[n:55]1([O:56][C:57]([N:58]([CH3:59])[CH3:60])=[N+:61]([CH3:62])[CH3:63])[c:64]2[n:65][cH:66][cH:67][cH:68][c:69]2[n:70][n:71]1>>[NH:2]([CH:3]([CH2:4][CH2:5][OH:6])[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[C:36]([C:21]1([NH:20][C:18]([O:17][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:19])[CH2:22][CH2:23][N:24]([c:27]2[c:28]3[c:29]([n:30][cH:31][n:32]2)[nH:33][cH:34][cH:35]3)[CH2:25][CH2:26]1)=[O:37]

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 2035001-Propanol, 3-amino-3-phenyl-HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 577503944-((tert-Butoxycarbonyl)amino)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid

Product 1

HCID 66673789HCID 66673789, compound

Sources & evidence

ORD record
ord-f55ee66c62694ae29d6b43e76abe52c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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