17-Ethyl-1,14-dihydroxy-12-[1-(4-hydroxy-3-methoxycyclohexyl)prop-1-en-2-yl]-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-tetrone → HCID 57183592, compound

HRID 693481Notes

Reaction equation

HRID 693481 reaction equation
[CH2:1]([CH3:2])[CH:3]1[C:4](=[O:56])[CH2:5][CH:6]([OH:55])[CH:7]([CH3:54])[CH:8]([C:42](=[CH:43][CH:44]2[CH2:45][CH:46]([O:51][CH3:52])[CH:47]([OH:50])[CH2:48][CH2:49]2)[CH3:53])[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.[Cl:57][C:58]([Cl:59])([Cl:60])[C:67](=[NH:68])[O:69][CH2:61][c:62]1[cH:63][cH:64][cH:65][o:66]1.[O:70]=[S:71](=[O:72])([OH:73])[CH2:74][C:75]12[CH2:76][CH2:77][CH:78]([C:79]1([CH3:80])[CH3:81])[CH2:82][C:83]2=[O:84]>>[CH2:1]([CH3:2])[CH:3]1[C:4](=[O:56])[CH2:5][CH:6]([OH:55])[CH:7]([CH3:54])[CH:8]([C:42](=[CH:43][CH:44]2[CH2:45][CH:46]([O:51][CH3:52])[CH:47]([O:50][CH2:61][c:62]3[cH:63][cH:64][cH:65][o:66]3)[CH2:48][CH2:49]2)[CH3:53])[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

4

Reactant 3

HCID 224117-Ethyl-1,14-dihydroxy-12-[1-(4-hydroxy-3-methoxycyclohexyl)prop-1-en-2-yl]-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-tetroneHCID 18462Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, (1S)-HCID 15199069HCID 15199069, compound

Product 1

HCID 57183592HCID 57183592, compound

Sources & evidence

ORD record
ord-ef8ae4c976e841c5bcbc02f8625541cf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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