General Information of the Compound
| Compound ID |
CP0391127
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| Compound Name |
(3aS,9bS)-3a-methyl-7-phenylmethoxy-2,3,4,9b-tetrahydro-1H-chromeno[3,4-b]pyrrole
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| Structure |
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| Formula |
C19H21NO2
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| Molecular Weight |
295.382
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| Canonical SMILES |
C[C@@]12COc3cc(OCc4ccccc4)ccc3[C@@H]1CCN2
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| InChI |
InChI=1S/C19H21NO2/c1-19-13-22-18-11-15(21-12-14-5-3-2-4-6-14)7-8-16(18)17(19)9-10-20-19/h2-8,11,17,20H,9-10,12-13H2,1H3/t17-,19+/m0/s1
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| InChIKey |
YONNIFKUSNFCMF-PKOBYXMFSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT03632, Sigma intracellular receptor 2
Protein ID: PT01509, Sigma non-opioid intracellular receptor 1