Water → HCID 178459438, compound

HRID 2318381Notes

Reaction equation

HRID 2318381 reaction equation
[C:75]([O-:76])(=[O:77])[CH2:78][CH2:79][CH2:80][CH2:81][CH2:82][CH2:83][CH3:84].[C:86]([O-:87])(=[O:88])[CH2:89][CH2:90][CH2:91][CH2:92][CH2:93][CH2:94][CH3:95].[CH2:39]([CH:40]=[CH2:41])[O:42][C:43](=[O:44])[N:45]1[CH:46]([CH2:51][O:52][CH2:53][CH2:54][F:55])[CH2:47][CH:48]([SH:50])[CH2:49]1.[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[CH3:63][C:64]#[N:65].[CH:66]([N:67]([CH:68]([CH3:69])[CH3:70])[CH2:71][CH3:72])([CH3:73])[CH3:74].[N+:1](=[C:3]([C:4](=[O:5])[O:6][CH2:7][CH:8]=[CH2:9])[C:10](=[O:2])[CH:11]([CH3:12])[CH:13]1[NH:14][C:15](=[O:20])[CH:16]1[CH:17]([CH3:18])[OH:19])=[N-:21].[OH2:56].[P:22]([Cl:23])([O:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)([O:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)=[O:38].[Rh+2:85]>>[C:3]1([C:4](=[O:5])[O:6][CH2:7][CH:8]=[CH2:9])=[C:10]([S:50][CH:48]2[CH2:47][CH:46]([CH2:51][O:52][CH2:53][CH2:54][F:55])[N:45]([C:43]([O:42][CH2:39][CH:40]=[CH2:41])=[O:44])[CH2:49]2)[CH:11]([CH3:12])[CH:13]2[N:14]1[C:15](=[O:20])[CH:16]2[CH:17]([CH3:18])[OH:19]

Participants

10

Reactant 9

HCID 962WaterHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 75654Diphenyl chlorophosphateHCID 81531DiisopropylethylamineHCID 119389Octanoate2×HCID 185497Rhodium, ion(Rh2)HCID 190870681-Allyloxycarbonyl-2-(2-fluoroethyloxymethyl)-4-mercaptopyrrolidineHCID 54331598Prop-2-enyl 2-diazo-4-[3-(1-hydroxyethyl)-4-oxoazetidin-2-yl]-3-oxopentanoate

Product 1

HCID 178459438HCID 178459438, compound

Sources & evidence

ORD record
ord-c6ee5d81ab814bb480f66aac3a496cbc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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