Water → HCID 178453707, compound

HRID 678181Notes

Reaction equation

HRID 678181 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][NH2:11].[CH3:45][CH:46]([OH:47])[CH3:48].[Cl:42][CH2:43][Cl:44].[OH2:41].[n:12]1([C:17](=[O:18])[O:19][CH:20]2[CH2:21][CH:22]3[C:23](=[O:40])[CH2:24][CH:25]4[CH:26]5[CH2:27][CH2:28][C:29](=[O:39])[C:30]5([CH3:31])[CH2:32][CH2:33][CH:34]4[C:35]3([CH3:38])[CH2:36][CH2:37]2)[cH:13][cH:14][n:15][cH:16]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][NH:11][C:17](=[O:18])[O:19][CH:20]1[CH2:21][CH:22]2[C:23](=[O:40])[CH2:24][CH:25]3[CH:26]4[CH2:27][CH2:28][C:29](=[O:39])[C:30]4([CH3:31])[CH2:32][CH2:33][CH:34]3[C:35]2([CH3:38])[CH2:36][CH2:37]1

Participants

6

Reactant 5

HCID 962WaterHCID 3776IsopropanolHCID 6344DichloromethaneHCID 187201N-BOC-ethylenediamineHCID 178421148HCID 178421148, compound

Product 1

HCID 178453707HCID 178453707, compound

Sources & evidence

ORD record
ord-5ec79b5df448422c8a796399f37c7702
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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