Bicarbonate Ion → HCID 90724750, compound

HRID 1117068Notes

Reaction equation

HRID 1117068 reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:2][CH2:3][O:4][C:5](=[O:6])[CH2:7][P:8]([O:9][CH2:10][CH3:11])([O:12][CH2:13][CH3:14])=[O:15].[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[LiH:1].[NH2:16][c:17]1[n:18][cH:19][n:20][n:21]2[c:22]1[c:23](-[c:28]1[cH:29][cH:30][c:31]([N+:34](=[O:35])[O-:36])[cH:32][cH:33]1)[c:24]([CH:26]=[O:27])[cH:25]2.[Na+:41].[O-:37][C:38]([OH:39])=[O:40]>>[CH3:2][CH2:3][O:4][C:5](=[O:6])[CH:7]=[CH:26][c:24]1[c:23](-[c:28]2[cH:29][cH:30][c:31]([N+:34](=[O:35])[O-:36])[cH:32][cH:33]2)[c:22]2[c:17]([NH2:16])[n:18][cH:19][n:20][n:21]2[cH:25]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 13345Triethyl phosphonoacetateHCID 57757971HCID 57757971, compoundHCID 178506917HCID 178506917, compound

Product 1

HCID 90724750HCID 90724750, compound

Sources & evidence

ORD record
ord-2f64a780f0b744b8977b64aabc3c3e74
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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