EVODEX Logo

EVODEX.1-P930

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]N([H])[C:2]([H])([C:3]([S:4](=[O:5])(=[O:6])[O:7][H:14])([H:15])[H:16])[C:8](=[O:9])[O:10][H:17]>>O=[C:2]([C:3]([S:4](=[O:5])(=[O:6])[O:7][H:14])([H:15])[H:16])[C:8](=[O:9])[O:10][H:17]

Derived Operators

EVODEX.1-F72 - Elemental Balance

O1
N-1
H-3

EVODEX.1-M60 - Mass Difference

-1.0316900000000002

EVODEX.1-C60 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7](-[H])-[#6@@:8]-[H]>>[#8]=[#6:8]

EVODEX.1-N42 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6@@:8](-[H])(-[#6:7])-[#6:10]>>[#8]=[#6:8](-[#6:7])-[#6:10]

EVODEX.1-Em340 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7](-[H])-[#6:8](-[H])(-[#6:7])-[#6:10]=[#8:11]>>[#8]=[#6:8](-[#6:7])-[#6:10]=[#8:11]

EVODEX.1-Cm97 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7]-[#6:8]-[H]>>[#8]=[#6:8]

EVODEX.1-Nm115 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7](-[H])-[#6:8](-[H])(-[#6:7])-[#6:10]>>[#8]=[#6:8](-[#6:7])-[#6:10]

Source Full Reactions

EVODEX.1-R915

Full Reaction Rendering

[H][C:2]([N:1]([H:19])[H:20])([C:3]([S:4](=[O:5])(=[O:6])[O:7][H:14])([H:15])[H:16])[C:8](=[O:9])[O:10][H:17].[O:12]=[O:13].[H][O:11][H]>>[C:2]([C:3]([S:4](=[O:5])(=[O:6])[O:7][H:14])([H:15])[H:16])([C:8](=[O:9])[O:10][H:17])=[O:11].[H][N:1]([H:19])[H:20].[H][O:12][O:13][H]

EVODEX.1-R3506

Full Reaction Rendering

[H][C@:2]([N:1]([H:26])[H:27])([C:3]([S:4](=[O:5])(=[O:6])[O:7][H:21])([H:22])[H:23])[C:8](=[O:9])[O:10][H:24].[O:11]=[C:12]([O:13][H:28])[C:14]([C:15]([C:16](=[O:17])[C:18](=[O:19])[O:20][H:29])([H:30])[H:31])([H:32])[H:33]>>[C:2]([C:3]([S:4](=[O:5])(=[O:6])[O:7][H:21])([H:22])[H:23])([C:8](=[O:9])[O:10][H:24])=[O:17].[H][C@:16]([N:1]([H:26])[H:27])([C:15]([C:14]([C:12](=[O:11])[O:13][H:28])([H:32])[H:33])([H:30])[H:31])[C:18](=[O:19])[O:20][H:29]