Ketohydroxy-Estratriene → HCID 11439824, compound
Reaction equation
[CH2:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[Br:30].[CH:1]12[CH2:2][CH2:3][C:4]3([CH3:5])[C:6](=[O:7])[CH2:8][CH2:9][CH:10]3[CH:11]1[CH2:12][CH2:13][c:14]1[cH:15][c:16]([OH:17])[cH:18][cH:19][c:20]12.[H-:22].[Na+:21].[O:32]=[CH:33][N:34]([CH3:35])[CH3:36].[OH2:31]>>[CH:1]12[CH2:2][CH2:3][C:4]3([CH3:5])[C:6](=[O:7])[CH2:8][CH2:9][CH:10]3[CH:11]1[CH2:12][CH2:13][c:14]1[cH:15][c:16]([O:17][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:18][cH:19][c:20]12Participants
7
Sources & evidence
- ORD record
- ord-b8abb6e073e54d06962f0fdc7bac5658
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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