Hexane → HCID 178445539, compound

HRID 124627Notes

Reaction equation

HRID 124627 reaction equation
[CH2:7]([O:8][NH:9][C:16]([CH:17]([CH2:18][CH:19]([CH3:20])[CH3:21])[N:22]([CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[P:30](=[O:31])([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[CH3:38])=[O:39])[c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1.[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH3:6].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45]>>[C:16]([CH:17]([CH2:18][CH:19]([CH3:20])[CH3:21])[N:22]([CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[P:30](=[O:31])([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[CH3:38])([OH:39])=[O:42]

Participants

4

Sources & evidence

ORD record
ord-0f4269406a0b4ae7a36a5be04ddbfd60
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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