Ethanol → HCID 178510532, compound

HRID 2124737Notes

Reaction equation

[CH3:37][CH2:38][OH:39].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[N:1](=[N+:2]=[N-:3])[CH2:4][c:5]1[cH:6][s:7][c:8]2[c:13]1[S:12](=[O:14])(=[O:15])[N:11]=[C:10]([C:16]1=[C:25]([OH:26])[CH:24]3[CH:19]([N:18]([CH2:28][c:29]4[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]4)[C:17]1=[O:36])[CH:20]1[CH2:21][CH2:22][CH:23]3[CH2:27]1)[NH:9]2>>[NH2:1][CH2:4][c:5]1[cH:6][s:7][c:8]2[c:13]1[S:12](=[O:14])(=[O:15])[N:11]=[C:10]([C:16]1=[C:25]([OH:26])[CH:24]3[CH:19]([N:18]([CH2:28][c:29]4[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]4)[C:17]1=[O:36])[CH:20]1[CH2:21][CH2:22][CH:23]3[CH2:27]1)[NH:9]2

Participants

Reactant 3

HCID 702Ethanol

HCID 8857Ethyl Acetate

HCID 1363910355-(7-Azidomethyl-1,1-dioxo-1,4-dihydro-1lambda6-thieno[2,3-e][1,2,4]thiadiazin-3-yl)-3-(4-fluoro-benzyl)-6-hydroxy-3-aza-tricyclo[6.2.1.02,7]undec-5-en-4-one

Product 1

HCID 178510532HCID 178510532, compound

Sources & evidence

ORD record: ord-6486fd038d294e07852d822ace6a2570
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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