Acetic Acid → [1-[3-[4-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-(3-formamido-4-hydroxyphenyl)ethyl]amino]methyl]-2,5-dimethylanilino]-3-oxopropyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate

HRID 1135988Notes

Reaction equation

HRID 1135988 reaction equation
[C:62]([O:63][BH-:64]([O:65][C:66](=[O:67])[CH3:68])[O:69][C:70](=[O:71])[CH3:72])(=[O:73])[CH3:74].[CH3:76][C:77](=[O:78])[OH:79].[CH3:80][OH:81].[CH:1](=[O:2])[c:3]1[cH:4][c:5]([CH3:37])[c:6]([NH:10][C:11](=[O:12])[CH2:13][CH2:14][N:15]2[CH2:16][CH2:17][CH:18]([O:21][C:22]([NH:23][c:24]3[c:25](-[c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[cH:26][cH:27][cH:28][cH:29]3)=[O:36])[CH2:19][CH2:20]2)[cH:7][c:8]1[CH3:9].[Cl:59][CH2:60][Cl:61].[NH2:38][CH2:39][CH:40]([O:41][Si:42]([CH3:43])([CH3:44])[C:45]([CH3:46])([CH3:47])[CH3:48])[c:49]1[cH:50][cH:51][c:52]([OH:58])[c:53]([NH:55][CH:56]=[O:57])[cH:54]1.[Na+:75]>>[CH2:1]([c:3]1[cH:4][c:5]([CH3:37])[c:6]([NH:10][C:11](=[O:12])[CH2:13][CH2:14][N:15]2[CH2:16][CH2:17][CH:18]([O:21][C:22]([NH:23][c:24]3[c:25](-[c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[cH:26][cH:27][cH:28][cH:29]3)=[O:36])[CH2:19][CH2:20]2)[cH:7][c:8]1[CH3:9])[NH:38][CH2:39][CH:40]([O:41][Si:42]([CH3:43])([CH3:44])[C:45]([CH3:46])([CH3:47])[CH3:48])[c:49]1[cH:50][cH:51][c:52]([OH:58])[c:53]([NH:55][CH:56]=[O:57])[cH:54]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 6344DichloromethaneHCID 2724942TriacetoxyborohydrideHCID 46239522Biphenyl-2-ylcarbamic acid 1-[2-(4-formyl-2,5-dimethylphenylcarbamoyl)ethyl]piperidin-4-yl esterHCID 76546866N-[5-[2-amino-1-[tert-butyl(dimethyl)silyl]oxyethyl]-2-hydroxyphenyl]formamide

Product 1

HCID 87086806[1-[3-[4-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-(3-formamido-4-hydroxyphenyl)ethyl]amino]methyl]-2,5-dimethylanilino]-3-oxopropyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate

Sources & evidence

ORD record
ord-790a7471b2cb4a0aaf7d2d4f88482b20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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