Methane → HCID 19611331, compound

HRID 2312455Notes

Reaction equation

HRID 2312455 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:16])[NH:17][c:18]3[c:19]([O:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:27][cH:28][c:29]([CH2:31][CH2:32][CH2:33][S:34](=[O:35])(=[O:36])[c:37]4[cH:38][cH:39][c:40]([Cl:43])[cH:41][cH:42]4)[cH:30]3)[cH:44][c:45]([NH:47][C:48]([O:49][CH2:50][c:51]3[cH:52][cH:53][c:54]([N+:55]([O-:56])=[O:57])[cH:58][cH:59]3)=[O:60])[cH:46]2)[s:8][cH:9]1.[C:71].[CH3:63][CH2:64][OH:65].[H:61][H:62].[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1.[Pd:72]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:16])[NH:17][c:18]3[c:19]([O:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:27][cH:28][c:29]([CH2:31][CH2:32][CH2:33][S:34](=[O:35])(=[O:36])[c:37]4[cH:38][cH:39][c:40]([Cl:43])[cH:41][cH:42]4)[cH:30]3)[cH:44][c:45]([NH2:47])[cH:46]2)[s:8][cH:9]1

Participants

7

Reactant 6

HCID 297MethaneHCID 702EthanolHCID 8028TetrahydrofuranHCID 23938PalladiumHCID 54318654HCID 54318654, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 19611331HCID 19611331, compound

Sources & evidence

ORD record
ord-463239d786a34550b781119a3495f0c2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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