Normorphine
Representations & DB's id
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ChEBI: | CHEBI:7633 | |
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ChEMBL: | CHEMBL1227 | |
PubChem: | 5462508 | |
IUPAC: | (4R,4aR,7S,7aR,12bS)-1,2,3,4,4a,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol | |
Standard InChI: | InChI=1S/C16H17NO3/c18-11-3-1-8-7-10-9-2-4-12(19)15-16(9,5-6-17-10)13(8)14(11)20-15/h1-4,9-10,12,15,17-19H,5-7H2/t9-,10+,12-,15-,16-/m0/s1 | |
Standard InChI Key: | ONBWJWYUHXVEJS-ZTYRTETDSA-N | |
SMILES: | O[C@H]1C=C[C@@H]2[C@@]34[C@H]1Oc1c4c(C[C@H]2NCC3)ccc1O |
Molecular propeties
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AlogP: | 0.86 | |
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Hydrogen bonds acceptors: | 4 | |
Hydrogen bonds donors: | 3 | |
Rotatable bonds: | 0 | |
Number of rings: | 5 | |
Molecular Weight: | 271.12 | |
Topological polar surface area: | 61.7 | |
Number of aromatic rings: | 1 | |
Fsp3: | 0.5 | |
Number of carbons: | 16 |