EVODEX.1-P2561

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2](=[C:3]([C:4]([O:5][P:6](=[O:7])([O:8][H:27])[O:9][P:10](=[O:11])([O:12][H:28])[O:13][H:29])([H:30])[H:31])[H:32])[H:33])([H:34])([H:35])[H:36].[H][N:14]([C:15]1:[C:16]([H:37]):[C:17]([H:38]):[C:18]([C:19]([C@:20]([N:21]([H:39])[H:40])([C:22](=[O:23])[O:24][H:41])[H:42])([H:43])[H:44]):[C:25]([H:45]):[C:26]:1[H:46])[H:47]>>[C:1]([C:2](=[C:3]([C:4]([N:14]([C:15]1:[C:16]([H:37]):[C:17]([H:38]):[C:18]([C:19]([C@:20]([N:21]([H:39])[H:40])([C:22](=[O:23])[O:24][H:41])[H:42])([H:43])[H:44]):[C:25]([H:45]):[C:26]:1[H:46])[H:47])([H:30])[H:31])[H:32])[H:33])([H:34])([H:35])[H:36].[H][O:5][P:6](=[O:7])([O:8][H:27])[O:9][P:10](=[O:11])([O:12][H:28])[O:13][H:29]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E178 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:4]-[#6:5](-[#8:6]-[#15:7])(-[H:48])-[H:49].[#7:15](-[#6:16])(-[H:67])-[H]>>[#6:4]-[#6:5](-[#7:15](-[#6:16])-[H:67])(-[H:48])-[H:49].[#8:6](-[#15:7])-[H]

EVODEX.1-C10 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:2]-[#8:4].[H]-[#7:19]>>[#6:2]-[#7:19].[H]-[#8:4]

EVODEX.1-N478 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:4]-[#6:5](-[#8:6]-[#15:7])(-[H:51])-[H:52].[H]-[#7:15](-[#6:16])-[H:71]>>[#6:4]-[#6:5](-[#7:15](-[#6:16])-[H:71])(-[H:51])-[H:52].[H]-[#8:6]-[#15:7]

EVODEX.1-Em514 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:4]-[#6:5]-[#8:6]-[#15:7].[H]-[#7:15]-[#6:16]>>[#6:4]-[#6:5]-[#7:15]-[#6:16].[H]-[#8:6]-[#15:7]

EVODEX.1-Cm34 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:2]-[#8:4].[H]-[#7:19]>>[#6:2]-[#7:19].[H]-[#8:4]

EVODEX.1-Nm465 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:4]-[#6:5]-[#8:6]-[#15:7].[H]-[#7:15]-[#6:16]>>[#6:4]-[#6:5]-[#7:15]-[#6:16].[H]-[#8:6]-[#15:7]

Source Full Reactions

EVODEX.1-R3301

Full Reaction Rendering

[C:1]([C:2](=[C:3]([C:4]([O:5][P:6](=[O:7])([O:8][H:27])[O:9][P:10](=[O:11])([O:12][H:28])[O:13][H:29])([H:30])[H:31])[H:32])[H:33])([H:34])([H:35])[H:36].[H][N:14]([C:15]1:[C:16]([H:37]):[C:17]([H:38]):[C:18]([C:19]([C@:20]([N:21]([H:39])[H:40])([C:22](=[O:23])[O:24][H:41])[H:42])([H:43])[H:44]):[C:25]([H:45]):[C:26]:1[H:46])[H:47]>>[C:1]([C:2](=[C:3]([C:4]([N:14]([C:15]1:[C:16]([H:37]):[C:17]([H:38]):[C:18]([C:19]([C@:20]([N:21]([H:39])[H:40])([C:22](=[O:23])[O:24][H:41])[H:42])([H:43])[H:44]):[C:25]([H:45]):[C:26]:1[H:46])[H:47])([H:30])[H:31])[H:32])[H:33])([H:34])([H:35])[H:36].[H][O:5][P:6](=[O:7])([O:8][H:27])[O:9][P:10](=[O:11])([O:12][H:28])[O:13][H:29]