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  3. EAWAG-BBD - 2025-04-29 19:23
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  5. bt0124-3980

1-unsubstituted Phenanthrenoid > 1-Phenanthrol derivative

Image Representation

SMIRKS Representation

[H:16][c:1]1[c:15][c:14][c:13][c:12]2[c:11]1[c:9][c:10][c:7]1[c:6][c:3][c:4][c:5][c:8]21>>[H:16][#8]-[c:1]1[c:15][c:14][c:13][c:12]2[c:11]1[c:9][c:10][c:7]1[c:6][c:3][c:4][c:5][c:8]21

Reactant SMARTS

[H:16][c:1]1[c:15][c:14][c:13][c:12]2[c:11]1[c:9][c:10][c:7]1[c:6][c:3][c:4][c:5][c:8]21

Reactant Filter SMARTS

None

Reactant SMARTS

[H:16][#8]-[c:1]1[c:15][c:14][c:13][c:12]2[c:11]1[c:9][c:10][c:7]1[c:6][c:3][c:4][c:5][c:8]21

Product Filter SMARTS

None

Included in Composite Rules

Scenarios

Reactions

Pathways