Chemical Component Summary | |
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Name | huprine 19 |
Formula | C18 H21 Cl N3 |
Molecular Weight | 314.832 |
Type | NON-POLYMER |
Isomeric SMILES | c1cc2c(cc1Cl)nc3c(c2N)[C@@H]4C[C@H](C3)CC(=C4)CC[NH3+] |
InChI | InChI=1S/C18H20ClN3/c19-13-1-2-14-15(9-13)22-16-8-11-5-10(3-4-20)6-12(7-11)17(16)18(14)21/h1-2,6,9,11-12H,3-5,7-8,20H2,(H2,21,22)/p+1/t11-,12+/m1/s1 |
InChIKey | JBGUOIGXEREJEV-NEPJUHHUSA-O |
Chemical Details | |
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Formal Charge | 1 |
Atom Count | 43 |
Chiral Atom Count | 2 |
Bond Count | 46 |
Aromatic Bond Count | 11 |
Related Resource References
Resource Name | Reference |
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PubChem | 137349474 |