Acetate → HCID 69078191, compound

HRID 2142452Notes

Reaction equation

HRID 2142452 reaction equation
[C:71]([O-:72])(=[O:73])[CH3:74].[C:76]([O-:77])(=[O:78])[CH3:79].[CH2:86]([N:87]([CH2:88][CH3:89])[CH2:90][CH3:91])[CH3:92].[CH3:58][N:59]([CH:60]=[O:61])[CH3:62].[CH3:63][OH:64].[CH3:65][CH2:66][CH2:67][CH2:68][CH2:69][CH3:70].[CH3:80][CH2:81][O:82][C:83](=[O:84])[CH3:85].[CH:1]1([N:4]([CH:5]2[c:6]3[cH:7][cH:8][c:9]([NH:17][C:18](=[O:19])[NH:20][c:21]4[cH:22][cH:23][c:24]([I:27])[cH:25][cH:26]4)[cH:10][c:11]3[C:12]([CH3:15])([CH3:16])[CH2:13][CH2:14]2)[CH3:28])[CH2:2][CH2:3]1.[Pd+2:75].[c:29]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[CH2:37][CH2:38][CH2:39][P:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:53][cH:54][cH:55][cH:56][cH:57]1>>[CH:1]1([N:4]([CH:5]2[c:6]3[cH:7][cH:8][c:9]([NH:17][C:18](=[O:19])[NH:20][c:21]4[cH:22][cH:23][c:24]([C:60](=[O:61])[O:64][CH3:63])[cH:25][cH:26]4)[cH:10][c:11]3[C:12]([CH3:15])([CH3:16])[CH2:13][CH2:14]2)[CH3:28])[CH2:2][CH2:3]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 887MethanolHCID 6228DimethylformamideHCID 8058HexaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 812191,3-Bis(diphenylphosphino)propaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 21107117HCID 21107117, compound

Product 1

HCID 69078191HCID 69078191, compound

Sources & evidence

ORD record
ord-3839660293824dc49e8da30599b6db30
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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