Hydrochloric Acid → HCID 57934510, compound

HRID 166992Notes

Reaction equation

HRID 166992 reaction equation
[C:1]([Si:2]([CH3:3])([CH3:4])[O:5][c:6]1[cH:7][cH:8][c:9]2[c:26]([cH:27]1)[CH2:25][CH2:24][CH2:23][CH:11]([c:12]1[cH:13][cH:14][c:15]([O:16][CH3:17])[cH:18][c:19]1[CH2:20][CH2:21][NH2:22])[CH2:10]2)([CH3:28])([CH3:29])[CH3:30].[C:49]([Si:50]([CH3:51])([CH3:52])[O:54][c:55]1[cH:56][cH:57][c:58]2[c:59]([cH:91]1)[CH2:60][CH2:61][CH2:62][CH:63]([c:65]1[c:66]([N:73]([CH2:74][c:75]3[cH:76][cH:77][c:78]([O:81][CH2:82][CH2:83][N:84]4[CH2:85][CH2:86][CH2:87][CH2:88]4)[cH:79][cH:80]3)[CH2:89][CH3:90])[cH:67][c:68]([O:71][CH3:72])[cH:69][cH:70]1)[CH2:64]2)([CH3:53])([CH3:92])[CH3:93].[ClH:31].[N:32]1([CH2:33][CH2:34][O:35][c:36]2[cH:37][cH:38][c:39]([C:40]([OH:41])=[O:42])[cH:43][cH:44]2)[CH2:45][CH2:46][CH2:47][CH2:48]1>>[OH:54][c:55]1[cH:56][cH:57][c:58]2[c:59]([cH:91]1)[CH2:60][CH2:61][CH2:62][CH:63]([c:65]1[c:66]([N:73]([CH2:74][c:75]3[cH:76][cH:77][c:78]([O:81][CH2:82][CH2:83][N:84]4[CH2:85][CH2:86][CH2:87][CH2:88]4)[cH:79][cH:80]3)[CH2:89][CH3:90])[cH:67][c:68]([O:71][CH3:72])[cH:69][cH:70]1)[CH2:64]2

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 65042284-(2-Pyrrolidin-1-yl-ethoxy)-benzoic acidHCID 66626847{2-[2-(tert-Butyldimethylsilyloxy)-6,7,8,9-tetrahydro-5H-benzocyclohepten-6-yl]-5-methoxyphenyl}ethylamineHCID 66627421HCID 66627421, compound

Product 1

HCID 57934510HCID 57934510, compound

Sources & evidence

ORD record
ord-dc515d417abe4fd0a9b4605dc3d183f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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