Acetic Acid → 9-Amino-19-benzyl-14,32-dichloro-5-methyl-26-oxa-4-thia-3,8,10,16,19-pentaazatetracyclo[25.2.2.212,15.02,6] tritriaconta-1(29),2,5,8,12,14,23,27,30,32-decaene-7,17-dione

HRID 2140939

Reaktionsgleichung

Reaktionsgleichung von HRID 2140939
[C:48]([O:49][BH-:50]([O:51][C:52](=[O:53])[CH3:54])[O:55][C:56](=[O:57])[CH3:58])(=[O:59])[CH3:60].[CH3:69][C:70](=[O:71])[OH:72].[CH:40](=[O:41])[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH:62]([O:63][CH3:64])([O:65][CH3:66])[O:67][CH3:68].[NH2:1][C:2]1=[N:3][C:4](=[O:39])[c:5]2[c:6]([CH3:38])[s:7][n:8][c:9]2-[c:10]2[cH:11][cH:12][c:13]([cH:36][cH:37]2)[O:14][CH2:15][CH:16]=[CH:17][CH2:18][CH2:19][CH2:20][NH:21][CH2:22][C:23](=[O:35])[NH:24][c:25]2[c:26]([Cl:34])[cH:27][c:28]([cH:31][c:32]2[Cl:33])[CH2:29][NH:30]1.[Na+:61]>>[NH2:1][C:2]1=[N:3][C:4](=[O:39])[c:5]2[c:6]([CH3:38])[s:7][n:8][c:9]2-[c:10]2[cH:11][cH:12][c:13]([cH:36][cH:37]2)[O:14][CH2:15][CH:16]=[CH:17][CH2:18][CH2:19][CH2:20][N:21]([CH2:40][c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[CH2:22][C:23](=[O:35])[NH:24][c:25]2[c:26]([Cl:34])[cH:27][c:28]([cH:31][c:32]2[Cl:33])[CH2:29][NH:30]1

Komponenten

7

Edukt 6

HCID 176Acetic AcidHCID 240BenzaldehydeHCID 923Sodium ionHCID 9005Trimethyl orthoformateHCID 2724942TriacetoxyborohydrideHCID 1784351489-Amino-14,32-dichloro-5-methyl-26-oxa-4-thia-3,8,10,16,19-pentaazatetracyclo[25.2.2.212,15.02,6]tritriaconta-1(29),2,5,8,12,14,23,27,30,32-decaene-7,17-dione

Produkt 1

HCID 1784351479-Amino-19-benzyl-14,32-dichloro-5-methyl-26-oxa-4-thia-3,8,10,16,19-pentaazatetracyclo[25.2.2.212,15.02,6] tritriaconta-1(29),2,5,8,12,14,23,27,30,32-decaene-7,17-dione

Quellen und Nachweise

ORD-Eintrag
ord-eb4abf8633c24bc4851d94750733e572
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

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