Phosphoric Acid → HCID 57617483, compound

HRID 2347439Notes

Reaction equation

HRID 2347439 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH2:7]([CH3:8])[n:9]1[c:10](=[O:30])[nH:11][c:12](=[O:29])[c:13]([CH:26]([CH3:27])[CH3:28])[c:14]1[C:15](=[O:16])[c:17]1[cH:18][c:19]([C:20]#[N:21])[cH:22][c:23]([CH3:25])[cH:24]1.[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[Cs+:5].[Cs+:6].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[P:31](=[O:32])([O:33][C:34]([CH3:35])([CH3:36])[CH3:37])([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[O:43][CH2:44][Cl:45].[P:46](=[O:47])([OH:48])([OH:49])[OH:50]>>[CH2:7]([CH3:8])[n:9]1[c:10](=[O:30])[n:11]([CH2:44][O:43][P:31](=[O:32])([O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[c:12](=[O:29])[c:13]([CH:26]([CH3:27])[CH3:28])[c:14]1[C:15](=[O:16])[c:17]1[cH:18][c:19]([C:20]#[N:21])[cH:22][c:23]([CH3:25])[cH:24]1

Participants

8

Reactant 7

HCID 1004Phosphoric AcidHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 11701630Di-tert-butyl (chloromethyl) phosphateHCID 25215428Ainuovirine

Product 1

HCID 57617483HCID 57617483, compound

Sources & evidence

ORD record
ord-98d6e2490cbd49eeaafcf195e6f53bf2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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