| Phytochemical Name : Tephrosin |
| PCNDIDT0022 |
| Pubchem CID : 114909 |
| Molecular formula: C23H22O7 |
| Canonical SMILES : CC1(C=CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4(C3=O)O)OC)OC)C |
Synonymes : Tephrosin|76-80-2|hydroxydeguelin|deguelinol I|(-)-TEPHROSIN|CHEBI:9442|UNII-9C081V83CC|CCRIS 7115|9C081V83CC|(1R,14R)-14-hydroxy-17,18-dimethoxy-7,7-dimethyl-2,8,21-trioxapentacyclo[12.8.0.03,12.04,9.015,20]docosa-3(12),4(9),5,10,15,17,19-heptaen-13-one|C23H22O7|3H-Bis(1)benzopyrano(3,4-b:6',5'-e)pyran-7(7aH)-one, 13,13a-dihydro-7a-hydroxy-9,10-dimethoxy-3,3-dimethyl-, (7aR,13aR)-|Deguelinol I;Hydroxydeguelin|(?)-Tephrosin|TEPHROSIN [MI]|SCHEMBL766277|CHEMBL241806|MEGxp0_001258|DTXSID20878627|HY-N1166|BDBM50505206|LMPK12060047|AKOS040740204|Tephrosin, >=95% (LC/MS-ELSD)|MS-27072|CS-0016457|Q7701343|(7aR,13aR)-13,13a-dihydro-7a-hydroxy-9,10-dimethoxy-3,3-dimethyl-3H-bis(1)benzopyrano(3,4-b:6',5'-e)pyran-7(7aH)-one|(7aR,13aR)-7a-hydroxy-9,10-dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one|3H-Bis(1)benzopyrano(3,4-b:6',5'-e)pyran-7(7aH)-one, 13,13a-dihydro-7a-hydroxy-9,10-dimethoxy-3,3-dimethyl-, (7aR-cis)- |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 3.790 |
| Log Po/w (XLOGP3) : 2.980 |
| Log Po/w (WLOGP) : 2.890 |
| Log Po/w (MLOGP) : 1.130 |
| Log Po/w (SILICOS-IT) : 3.600 |
| Consensus Log Po/w : 2.880 |

