Indole-3-Acetic Acid → (3aRS,4RS,6SR,7aSR)-2-(3-indolylacetyl)-4-(2-methoxyphenyl)-6-methyl-4-perhydroisoindolol

HRID 110649

Reaction equation

HRID 110649 reaction equation
[CH3:1][O:2][c:3]1[c:4]([C:9]2([OH:19])[CH:10]3[CH2:11][NH:12][CH2:13][CH:14]3[CH2:15][CH:16]([CH3:18])[CH2:17]2)[cH:5][cH:6][cH:7][cH:8]1.[nH:20]1[cH:21][c:22]([CH2:29][C:30](=[O:31])[OH:32])[c:23]2[cH:24][cH:25][cH:26][cH:27][c:28]12>>[CH3:1][O:2][c:3]1[c:4]([C:9]2([OH:19])[CH:10]3[CH2:11][N:12]([C:30]([CH2:29][c:22]4[cH:21][nH:20][c:28]5[c:23]4[cH:24][cH:25][cH:26][cH:27]5)=[O:31])[CH2:13][CH:14]3[CH2:15][CH:16]([CH3:18])[CH2:17]2)[cH:5][cH:6][cH:7][cH:8]1

Participants

3

Reactant 2

HCID 802Indole-3-Acetic AcidHCID 19957564(3aRS,4RS,6SR,7aSR)-4-(2-methoxyphenyl)-6-methyl-4 perhydroisoindolol

Product 1

HCID 67714515(3aRS,4RS,6SR,7aSR)-2-(3-indolylacetyl)-4-(2-methoxyphenyl)-6-methyl-4-perhydroisoindolol

Sources & evidence

ORD record
ord-e080aa1db54a48ce800ca184015e0ea3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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