Bicarbonate Ion → HCID 178444939, compound

HRID 2340101Notes

Reaction equation

HRID 2340101 reaction equation
[C:28](=[O:29])([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[NH:35][CH:36]([CH:37]([CH3:38])[CH2:39][CH3:40])[C:41](=[O:42])[OH:43].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[Cl:82][CH2:83][Cl:84].[NH2:1][CH2:2][CH:3]([c:4]1[cH:5][cH:6][c:7]([O:10][CH2:11][CH:12]([CH2:13][CH2:14][CH3:15])[CH3:16])[cH:8][cH:9]1)[NH:17][C:18]([CH:19]([CH3:20])[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)=[O:27].[Na+:81].[O-:77][C:78]([OH:79])=[O:80].[P-:53]([F:54])([F:55])([F:56])([F:57])([F:58])[F:59].[n:60]1([O:61][C:62]([N:63]([CH3:64])[CH3:65])=[N+:66]([CH3:67])[CH3:68])[c:69]2[n:70][cH:71][cH:72][cH:73][c:74]2[n:75][n:76]1>>[NH:1]([CH2:2][CH:3]([c:4]1[cH:5][cH:6][c:7]([O:10][CH2:11][CH:12]([CH2:13][CH2:14][CH3:15])[CH3:16])[cH:8][cH:9]1)[NH:17][C:18]([CH:19]([CH3:20])[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)=[O:27])[C:41]([CH:36]([NH:35][C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[CH:37]([CH3:38])[CH2:39][CH3:40])=[O:42]

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4336232-((Tert-butoxycarbonyl)amino)-3-methylpentanoic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 76794692N-[2-amino-1-[4-(2-methylpentoxy)phenyl]ethyl]-2-phenylpropanamide

Product 1

HCID 178444939HCID 178444939, compound

Sources & evidence

ORD record
ord-8c1b6c287bc545cdacf8308dfc1c3c72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…