| Phytochemical Name : Guggulsterone |
| PCNDIDG0152 |
| Pubchem CID : 6450278 |
| Molecular formula: C21H28O2 |
| Canonical SMILES : CC=C1C(=O)CC2C1(CCC3C2CCC4=CC(=O)CCC34C)C |
Synonymes : (Z)-Guggulsterone|Z-Guggulsterone|Guggulsterone|39025-23-5|95975-55-6|Guggulsterones Z|Cis-Guggulsterone|GUGGULSTERONE Z|Guggulsterone, (Z)-|Guggulsterone E&Z|UNII-6CST3U34GN|6CST3U34GN|DTXSID1033539|(Z)-Pregna-4,17(20)-diene-3,16-dione|Z/E-Guggulsterone|Pregna-4,17(20)-diene-3,16-dione, (17Z)-|Pregna-4,17(20)-diene-3,16-dione|(8R,9S,10R,13S,14S,17Z)-17-ethylidene-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthrene-3,16-dione|Gugulsterone|(17Z)-Guggulsterone|(17Z)-Pregna-4,17(20)-diene-3,16-dione|4,17(20)-cis-Pregnadiene-3,6-dione|Guggulsterones E&Z|GS|(17Z)-pregna-4,17-diene-3,16-dione|(E&Z)-Guggulsterone|GUGGULSTERONE Z-FORM|SCHEMBL141657|CHEMBL410683|DTXCID9013539|BDBM21725|GUGGULSTERONE Z [USP-RS]|CHEBI:135338|GUGGULSTERONE Z-FORM [MI]|BCP18087|Tox21_202518|AKOS015963432|(Z)-Guggulsterone, analytical standard|AC-6215|CCG-267610|NCGC00091910-01|NCGC00260067-01|AC-28813|AS-79083|pregna-4,17Z(20)-diene-3,16-dione|CAS-39025-23-5|HY-107738|CS-0029421|S3792|(Z)-Guggulsterone, >=89% (HPLC), powder|2-(2-Aminothiazol-3(2H)-yl)-1-phenylethanone|BRD-K26674531-001-01-3|GUGGULSTERONE Z (CONSTITUENT OF GUGGUL) [DSC]|Q27264514|Guggulsterone Z, United States Pharmacopeia (USP) Reference Standard|(1S,2R,10R,11S,14Z,15S)-14-ethylidene-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-ene-5,13-dione |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.980 |
| Log Po/w (XLOGP3) : 3.940 |
| Log Po/w (WLOGP) : 4.640 |
| Log Po/w (MLOGP) : 3.860 |
| Log Po/w (SILICOS-IT) : 4.740 |
| Consensus Log Po/w : 4.030 |

