Hexane → HCID 178501636, compound

HRID 201187Notes

Reaction equation

HRID 201187 reaction equation
[CH3:1][O:2][C:3](=[O:4])[CH:5]([CH:6]([CH3:7])[CH3:8])[NH:9][C:10](=[S:11])[c:12]1[c:13](-[c:18]2[c:19]([C:24](=[S:25])[NH:26][CH:27]([C:28](=[O:29])[O:30][CH3:31])[CH:32]([CH3:33])[CH3:34])[cH:20][cH:21][cH:22][cH:23]2)[cH:14][cH:15][cH:16][cH:17]1.[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40].[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46]>>[CH3:1][O:2][C:3](=[O:4])[CH:5]([CH:6]([CH3:7])[CH3:8])[NH:9][C:10](=[S:11])[c:12]1[c:13](-[c:18]2[c:19]([C:24]([NH:26][CH:27]([C:28](=[O:29])[O:30][CH3:31])[CH:32]([CH3:33])[CH3:34])=[O:43])[cH:20][cH:21][cH:22][cH:23]2)[cH:14][cH:15][cH:16][cH:17]1

Participants

4

Reactant 3

HCID 8058HexaneHCID 8857Ethyl AcetateHCID 178501723HCID 178501723, compound

Product 1

HCID 178501636HCID 178501636, compound

Sources & evidence

ORD record
ord-27057a7c5f0e4acaa44574ae7c860931
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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