Hydrochloric Acid → HCID 178498859, compound

HRID 311084Notes

Reaction equation

HRID 311084 reaction equation
[CH2:59]1[CH2:60][C:61]12[CH:62]([OH:67])[CH2:63][NH:64][CH2:65][CH2:66]2.[CH2:75]1[O:76][CH2:77][CH2:78][CH2:79]1.[CH3:1][O:2][C:3](=[O:4])[CH:5]1[CH2:6][N:7]([C:23](=[O:24])[O:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[CH:8]([CH3:22])[C:9](=[O:21])[N:10]1[CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20].[CH3:68][CH2:69][N:70]([CH2:71][CH3:72])[CH2:73][CH3:74].[ClH:33].[ClH:58].[O:80]=[CH:81][N:82]([CH3:83])[CH3:84].[P-:34]([F:35])([F:36])([F:37])([F:38])([F:39])[F:40].[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[n:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1>>[CH3:1][O:2][C:3](=[O:4])[CH:5]1[CH2:6][N:7]([C:23](=[O:24])[O:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[CH:8]([CH3:22])[C:9](=[O:21])[N:10]1[CH2:11][CH2:12][CH2:13][C:14](=[O:15])[N:64]1[CH2:63][CH:62]([OH:67])[C:61]2([CH2:59][CH2:60]2)[CH2:66][CH2:65]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 667827006-Azaspiro[2.5]octan-4-olHCID 67074147HCID 67074147, compound

Product 1

HCID 178498859HCID 178498859, compound

Sources & evidence

ORD record
ord-f088adf23960485283b1df73d5559891
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…