EVODEX.1-C182

SMIRKS

[H]-[#7:45]>>[H]-[#8]-[#6](-[H])(-[H])-[#6@@]1(-[H])-[#8]-[#6@](-[H])(-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6](-[H])(-[H])-[#6@@]2(-[H])-[#8]-[#6@@](-[H])(-[#7]3:[#6](-[H]):[#6](-[H]):[#6](=[#8]):[#7](-[H]):[#6]:3=[#8])-[#6@](-[H])(-[#8]-[H])-[#6@]-2(-[H])-[#8]-[H])-[#6@](-[H])(-[#7](-[H])-[#6](=[#8])-[#6](-[H])(-[H])-[H])-[#6@@](-[H])(-[#8]-[#6@@](-[H])(-[#6](=[#8])-[#7:45])-[#6](-[H])(-[H])-[H])-[#6@]-1(-[H])-[#8]-[H]

Source Partial Reactions

EVODEX.1-P7162

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EVODEX.1-P7505

[H][N:49]([C@@:48]([C:46]([C:45]([H:123])([H:124])[H:125])([C:47]([H:115])([H:116])[H:117])[H:122])([C:50](=[O:51])[O:52][H:120])[H:121])[H:118]>>[H]OC([H])([H])[C@@]1([H])O[C@]([H])(OP(=O)(O[H])OP(=O)(O[H])OC([H])([H])[C@@]2([H])O[C@@]([H])(N3:C([H]):C([H]):C(=O):N([H]):C:3=O)[C@]([H])(O[H])[C@]2([H])O[H])[C@]([H])(N([H])C(=O)C([H])([H])[H])[C@@]([H])(O[C@@]([H])(C(=O)[N:49]([C@@:48]([C:46]([C:45]([H:123])([H:124])[H:125])([C:47]([H:115])([H:116])[H:117])[H:122])([C:50](=[O:51])[O:52][H:120])[H:121])[H:118])C([H])([H])[H])[C@]1([H])O[H]

EVODEX.1-P7509

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EVODEX.1-P7510

[H][N:52]([C@:50]([C:48]([O:47][C:46]([C:45]([H:123])([H:124])[H:125])([H:121])[H:122])=[O:49])([C:51]([H:115])([H:116])[H:117])[H:120])[H:118]>>[H]OC([H])([H])[C@@]1([H])O[C@]([H])(OP(=O)(O[H])OP(=O)(O[H])OC([H])([H])[C@@]2([H])O[C@@]([H])(N3:C([H]):C([H]):C(=O):N([H]):C:3=O)[C@]([H])(O[H])[C@]2([H])O[H])[C@]([H])(N([H])C(=O)C([H])([H])[H])[C@@]([H])(OC([H])(C(=O)[N:52]([C@:50]([C:48]([O:47][C:46]([C:45]([H:123])([H:124])[H:125])([H:121])[H:122])=[O:49])([C:51]([H:115])([H:116])[H:117])[H:120])[H:118])C([H])([H])[H])[C@]1([H])O[H]

EVODEX.1-P7514

[H][N:47]([C:46]([C:45]([H:118])([H:119])[H:120])([C:48]([N:49]([H:115])[H:116])=[O:50])[H:117])[H:113]>>[H]OC([H])([H])[C@@]1([H])O[C@]([H])(OP(=O)(O[H])OP(=O)(O[H])OC([H])([H])[C@@]2([H])O[C@@]([H])(N3:C([H]):C([H]):C(=O):N([H]):C:3=O)[C@]([H])(O[H])[C@]2([H])O[H])[C@]([H])(N([H])C(=O)C([H])([H])[H])[C@@]([H])(O[C@@]([H])(C(=O)[N:47]([C:46]([C:45]([H:118])([H:119])[H:120])([C:48]([N:49]([H:115])[H:116])=[O:50])[H:117])[H:113])C([H])([H])[H])[C@]1([H])O[H]

EVODEX.1-P7517

[H][N:5]([C:4]([C:3]([C:2]#[C:1][H:121])([H:119])[H:120])([C:6](=[O:7])[O:8][H:117])[H:118])[H:115]>>[H]OC([H])([H])[C@@]1([H])O[C@]([H])(OP(=O)(O[H])OP(=O)(O[H])OC([H])([H])[C@@]2([H])O[C@@]([H])(N3:C([H]):C([H]):C(=O):N([H]):C:3=O)[C@]([H])(O[H])[C@]2([H])O[H])[C@]([H])(N([H])C(=O)C([H])([H])[H])[C@@]([H])(O[C@@]([H])(C(=O)[N:5]([C:4]([C:3]([C:2]#[C:1][H:121])([H:119])[H:120])([C:6](=[O:7])[O:8][H:117])[H:118])[H:115])C([H])([H])[H])[C@]1([H])O[H]

EVODEX.1-P7519

[H][N:45]([C:46]([C:47]([C:48](=[O:49])[O:50][H:113])([H:114])[H:115])([H:116])[H:117])[H:118]>>[H]OC([H])([H])[C@@]1([H])O[C@]([H])(OP(=O)(O[H])OP(=O)(O[H])OC([H])([H])[C@@]2([H])O[C@@]([H])(N3:C([H]):C([H]):C(=O):N([H]):C:3=O)[C@]([H])(O[H])[C@]2([H])O[H])[C@]([H])(N([H])C(=O)C([H])([H])[H])[C@@]([H])(O[C@@]([H])(C(=O)[N:45]([C:46]([C:47]([C:48](=[O:49])[O:50][H:113])([H:114])[H:115])([H:116])[H:117])[H:118])C([H])([H])[H])[C@]1([H])O[H]