Ethanol → HCID 178453109, compound

Reaction equation

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][C:9]1([C:17]#[N:18])[CH2:10][C:11]12[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)=[O:19].[CH3:22][CH2:23][OH:24].[NH2:20][OH:21]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][C:9]1([C:17](=[NH:18])[NH:20][OH:21])[CH2:10][C:11]12[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)=[O:19]

Participants

Reactant 3

HCID 702Ethanol

HCID 787Hydroxylamine

HCID 69515964(1-Cyano-spiro[2.5]oct-1-ylmethyl)-carbamic acid tert-butyl ester

Product 1

HCID 178453109HCID 178453109, compound

Sources & evidence

ORD record: ord-09cda2fec1464a92a8a72303c972a5a3
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…