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Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
6 steps
Depiction
Dead-End Product
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
4 steps
Depiction
Dead-End Product
CID 22568690
C([N+](=O)[O-])([O-])=O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
5 steps
Depiction
Dead-End Product
Nitromethane
C[N+](=O)[O-]
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
4 steps
Depiction
Dead-End Product
Methanamine, N-methylene-, N-oxide
[N+](=C)(C)[O-]
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
7 steps
Depiction
Dead-End Product
2-hydroxy-N-methyl-2-oxoethanimine oxide
C(=O)(C=[N+](C)[O-])O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
7 steps
Depiction
Dead-End Product
C(=O)(C[N+](=C)[O-])O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
3 steps
Depiction
Dead-End Product
Cholestan-3-one
CC(CCCC(C)C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)=O)C)C
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
4 steps
Depiction
Dead-End Product
C[N+](C)(CCNO)Cl
Depiction
Upstream Precursor
2-[[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-trimethylazanium
C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@…
Depth 1
Depiction
Product
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 2
Depiction
Downstream Successor
Dimethylaminium
C[NH2+]C
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 3
Depiction
Downstream Successor
Methylamine
NC
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 3
Depiction
Downstream Successor
Aminoacetaldehyde
NCC=O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 3
Depiction
Downstream Successor
Dimethylhydroxylamine
N(C)(C)O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 3
Depiction
Downstream Successor
Dimethyl(2-oxoethyl)azanium
[NH+](C)(C)CC=O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 3
Depiction
Downstream Successor
N-oxocarbamate
C(N=O)([O-])=O
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 3
Depiction
Downstream Successor
2-(Carboxyamino)acetate
C(NCC(=O)O)(=O)[O-]
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 1
Depiction
Downstream Successor
Cholest-5-en-3-ol
CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 3
Depiction
Downstream Successor
N-Methylethylenediamine
NCCNC
Depiction
Precursor
2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethyl-dimethylazanium
CC(CCCC(C)C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NCC[NH+](C)C)C)C
Depth 2
Depiction
Downstream Successor
2-Aminoethyl(dimethyl)azanium
NCC[NH+](C)C
No Original Precursors

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