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Methanol → HCID 70489858, compound

HRID 152497
Notes
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Reaction equation

HRID 152497 reaction equation
[C:7]([OH:8])(=[O:9])[C:10]([OH:11])=[O:12].[CH2:47]([O:48][CH2:49][CH3:50])[CH3:51].[CH3:13][N:14]([CH3:15])[CH2:16][c:17]1[cH:18][cH:19][c:20]([CH2:22][SH:23])[o:21]1.[CH3:45][OH:46].[Na+:1].[Na+:2].[Na+:30].[Na+:31].[O-:3][C:4](=[O:5])[O-:6].[OH2:44].[OH:32][CH2:33][CH2:34][NH:35][C:36]([N:37]1[CH2:38][CH2:39]1)=[CH:40][N+:41](=[O:42])[O-:43].[S:24]([S:25]([O-:26])=[O:27])([O-:28])=[O:29]>>[CH3:13][N:14]([CH3:15])[CH2:16][c:17]1[cH:18][cH:19][c:20]([CH2:22][S:23][CH2:39][CH2:38][NH:37][C:36]([NH:35][CH2:34][CH2:33][OH:32])=[CH:40][N+:41](=[O:42])[O-:43])[o:21]1
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 887MethanolHCID 923Sodium Ion4×HCID 962WaterHCID 971Oxalic AcidHCID 1086DithioniteHCID 3283Diethyl EtherHCID 19660Carbonate Ion
HCID 12888900
{5-[(Dimethylamino)methyl]furan-2-yl}methanethiol
HCID 713219382-{[1-(Aziridin-1-yl)-2-nitroethenyl]amino}ethan-1-ol

Product 1

HCID 70489858HCID 70489858, compound

Sources & evidence

ORD record
ord-90597affbf5b459d9b57ec82bc9f772a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes