| Phytochemical Name : Rhapontin |
| PCNDIDR0024 |
| Pubchem CID : 637213 |
| Molecular formula: C21H24O9 |
| Canonical SMILES : COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O |
Synonymes : rhapontin|Rhaponticin|155-58-8|Ponticin|Rhaponiticin|Rhaponticine|NSC 43321|UNII-K691M2Z08V|CHEBI:8824|K691M2Z08V|EINECS 205-845-0|Rhapontigenin, 3-beta-D-glucopyranoside|Glucopyranoside, rhapontigenin-3, beta-D-|3-hydroxy-5-[2-(3-hydroxy-4-methoxyphenyl)vinyl]phenyl-beta-d-glucopyranoside|beta-D-Glucopyranoside, 3-hydroxy-5-(2-(3-hydroxy-4-methoxyphenyl)ethenyl)phenyl|NSC-43321|Rhaponticin,(S)|3-Hydroxy-5-(2-(3-hydroxy-4-methoxyphenyl)vinyl)phenyl-beta-D-glucopyranoside|Rose oxide (cis)|(2S,3R,4S,5S,6R)-2-(3-hydroxy-5-(3-hydroxy-4-methoxystyryl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol|Rhapontin, 65%|Rhapontigenin glucoside|RHAPONTIN [MI]|Spectrum5_001757|BSPBio_002946|MLS002207294|Rhapontin, analytical standard|SCHEMBL160068|CHEMBL109266|CHEBI:92176|HMS503I09|DTXSID201018153|GLXC-13093|HY-N0671|CCG-38881|LMPK13090002|MFCD00010117|s9083|AKOS016034205|3-Hydroxy-5-(2-(3-hydroxy-4-methoxyphenyl)ethenyl)phenyl-beta-D-glucopyranoside|IDI1_001004|NCGC00178379-01|(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(3-hydroxy-4-methoxy-phenyl)vinyl]phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol|(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol|3,3 inverted exclamation marka,5-Trihydroxy-4 inverted exclamation marka-methoxystilbene 3-O-|A-D-glucoside|AC-34809|AS-77402|SMR001306806|CS-0009703|R0252|A809657|SR-05000002217|Q-100184|Q7320229|SR-05000002217-2|BRD-K10098805-001-02-0|3,3',5-Trihydroxy-4'-methoxystilbene 3-O-beta-D-glucoside|(E)-3-Hydroxy-5-[2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenyl -beta-D-glucopyranoside|.beta.-D-Glucopyranoside, 3-hydroxy-5-[(1E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenyl|beta-D-Glucopyranoside, 3-hydroxy-5-[(1E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenyl|ss-D-Glucopyranoside, 3-hydroxy-5-[(1E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenyl|(2S,3R,4S,5S,6R)-2-(3-hydroxy-5-((E)-3-hydroxy-4-methoxystyryl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol|3-HYDROXY-5-((1E)-2-(3-HYDROXY-4-METHOXYPHENYL)ETHENYL)PHENYL .BETA.-D-GLUCOPYRANOSIDE |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.390 |
| Log Po/w (XLOGP3) : 0.520 |
| Log Po/w (WLOGP) : 0.240 |
| Log Po/w (MLOGP) : -0.650 |
| Log Po/w (SILICOS-IT) : 0.550 |
| Consensus Log Po/w : 0.610 |