3',6',10,11B-Tetramethylspiro[2,3,4,6,6A,6B,7,8,11,11A-Decahydro-1H-Benzo[A]Fluorene-9,2'-3A,4,5,6,7,7A-Hexahydro-3H-Furo[3,2-B]Pyridine]-3-Ol
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL2132004 | |
| PubChem: | 4113848 | |
| IUPAC: | 3',6',10,11b-tetramethylspiro[2,3,4,6,6a,6b,7,8,11,11a-decahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-ol | |
| Standard InChI: | InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3 | |
| Standard InChI Key: | QASFUMOKHFSJGL-UHFFFAOYSA-N | |
| SMILES: | OC1CCC2(C(=CCC3C2CC2=C(C)C4(CCC32)OC2C(C4C)NCC(C2)C)C1)C | |
Molecular propeties
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| AlogP: | 5 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 6 | |
| Molecular Weight: | 411.31 | |
| Topological polar surface area: | 41.5 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.852 | |
| Number of carbons: | 27 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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