HCID 178465330, compound → HCID 178465329, compound

HRID 1230268Notes

Reaction equation

HRID 1230268 reaction equation
[CH2:41]([CH3:42])[NH:43][C:44]([NH:45][CH:46]([C:47](=[O:48])[N:49]1[CH:50]([C:54](=[O:55])[OH:56])[CH2:51][CH2:52][CH2:53]1)[CH2:57][c:58]1[cH:59][cH:60][c:61]([O:64][CH3:65])[cH:62][cH:63]1)=[O:66].[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH2:12][NH:13][C:14]([CH:15]3[CH2:16][CH2:17][CH2:18][N:19]3[C:20](=[O:21])[CH:22]([NH:23][C:24](=[O:25])[CH3:26])[CH2:27][c:28]3[cH:29][cH:30][c:31](-[c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[cH:38][cH:39]3)=[O:40])[cH:9][cH:10][c:11]12>>[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH2:12][NH:13][C:54]([CH:50]3[N:49]([C:47]([CH:46]([NH:45][C:44]([NH:43][CH2:41][CH3:42])=[O:66])[CH2:57][c:58]4[cH:59][cH:60][c:61]([O:64][CH3:65])[cH:62][cH:63]4)=[O:48])[CH2:53][CH2:52][CH2:51]3)=[O:55])[cH:9][cH:10][c:11]12

Participants

3

Reactant 2

HCID 178465330HCID 178465330, compoundHCID 178474661HCID 178474661, compound

Product 1

HCID 178465329HCID 178465329, compound

Sources & evidence

ORD record
ord-acaa54e63f854682add9ef0d49e76a26
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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