Dichloromethane → 17-Ethyl-1-hydroxy-14-(tert-butyldimethylsiloxy)-12-[2'-(4"-(o-nitrobenzenesulfonyloxy)-3"-allyloxycyclohexyl)-1'-methylvinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetraone

HRID 1124137Notes

Reaction equation

HRID 1124137 reaction equation
[CH2:1]([CH3:2])[CH:3]1[C:4](=[O:65])[CH2:5][CH:6]([O:57][Si:58]([CH3:59])([CH3:60])[C:61]([CH3:62])([CH3:63])[CH3:64])[CH:7]([CH3:56])[CH:8]([C:42](=[CH:43][CH:44]2[CH2:45][CH:46]([O:51][CH2:52][CH:53]=[CH2:54])[CH:47]([OH:50])[CH2:48][CH2:49]2)[CH3:55])[O:9][C:10](=[O:41])[CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][N:16]2[C:17](=[O:40])[C:18](=[O:39])[C:19]2([OH:38])[CH:20]([CH3:37])[CH2:21][CH:22]([O:35][CH3:36])[CH:23]([CH:24]([O:32][CH3:33])[CH2:25][CH:26]([CH3:31])[CH2:27][C:28]([CH3:30])=[CH:29]1)[O:34]2.[CH2:88]([Cl:89])[Cl:90].[CH3:100][CH2:101][O:102][C:103](=[O:104])[CH3:105].[CH3:91][N:92]([CH3:93])[c:94]1[cH:95][cH:96][n:97][cH:98][cH:99]1.[CH:66]([N:67]([CH:68]([CH3:69])[CH3:70])[CH2:71][CH3:72])([CH3:73])[CH3:74].[N+:75](=[O:76])([O-:77])[c:78]1[c:79]([S:84](=[O:85])(=[O:86])[Cl:87])[cH:80][cH:81][cH:82][cH:83]1>>[CH2:1]([CH3:2])[CH:3]1[C:4](=[O:65])[CH2:5][CH:6]([O:57][Si:58]([CH3:59])([CH3:60])[C:61]([CH3:62])([CH3:63])[CH3:64])[CH:7]([CH3:56])[CH:8]([C:42](=[CH:43][CH:44]2[CH2:45][CH:46]([O:51][CH2:52][CH:53]=[CH2:54])[CH:47]([O:50][S:84]([c:79]3[c:78]([N+:75](=[O:76])[O-:77])[cH:83][cH:82][cH:81][cH:80]3)(=[O:85])=[O:86])[CH2:48][CH2:49]2)[CH3:55])[O:9][C:10](=[O:41])[CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][N:16]2[C:17](=[O:40])[C:18](=[O:39])[C:19]2([OH:38])[CH:20]([CH3:37])[CH2:21][CH:22]([O:35][CH3:36])[CH:23]([CH:24]([O:32][CH3:33])[CH2:25][CH:26]([CH3:31])[CH2:27][C:28]([CH3:30])=[CH:29]1)[O:34]2

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 142844-(Dimethylamino)pyridineHCID 155402-Nitrobenzenesulfonyl chlorideHCID 81531DiisopropylethylamineHCID 5697563717-Ethyl-1-hydroxy-14-(tert-butyldimethylsiloxy)-12-[2'-(4"-hydroxy-3"-allyloxycyclohexyl)-1'-methylvinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetraone

Product 1

HCID 5708627117-Ethyl-1-hydroxy-14-(tert-butyldimethylsiloxy)-12-[2'-(4"-(o-nitrobenzenesulfonyloxy)-3"-allyloxycyclohexyl)-1'-methylvinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetraone

Sources & evidence

ORD record
ord-96a4c21dffb0494a931c1ac78ee88bdf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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