Bicarbonate Ion → HCID 21262378, compound

HRID 2126432Notes

Reaction equation

HRID 2126432 reaction equation
[C:53]([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)(=[S:60])[OH:61].[CH2:1]([CH:2]=[CH2:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH:9]([OH:21])[CH2:10][CH:11]1[CH2:12][c:13]1[n:14][cH:15][n:16]2[c:17]1[s:18][cH:19][cH:20]2.[CH2:67]1[O:68][CH2:69][CH2:70][CH2:71]1.[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[Na+:62].[O:41]=[C:42]([O:43][CH2:44][CH3:45])[N:46]=[N:47][C:48]([O:49][CH2:50][CH3:51])=[O:52].[OH:63][C:64](=[O:65])[O-:66].[c:22]1([P:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[CH2:1]([CH:2]=[CH2:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH:9]([S:60][C:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)=[O:61])[CH2:10][CH:11]1[CH2:12][c:13]1[n:14][cH:15][n:16]2[c:17]1[s:18][cH:19][cH:20]2

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 178459722HCID 178459722, compoundHCID 178526132HCID 178526132, compound

Product 1

HCID 21262378HCID 21262378, compound

Sources & evidence

ORD record
ord-3a01b9022e2b44bb989999c4e585dd52
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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