Compound | Xenognosin A |
NPACT-Id | NPACT01384 |
IUPAC | - |
Synonyms | 4-[(E)-3-(4-hydroxyphenyl)prop-2-enyl]-3-methoxyphenol |
PubChem Id | 5281296 |
Class | Flavonoid |
In-vitro anticancer activity | 2 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | LOHIEGDVOARVPJ-NSCUHMNNSA-N |
InChi | 1S/C16H16O3/c1-19-16-11-15(18)10-7-13(16)4-2-3-12-5-8-14(17)9-6-12/h2-3,5-11,17-18H,4H2,1H3/b3-2+ |
SMILES | O(c1c(C/C=C/c2ccc(O)cc2)ccc(O)c1)C |
SMART | [H]OC1=C([H])C([H])=C(C([H])=C(/[H])C([H])([H])C2=C(OC([H])([H])[H])C([H])=C(O[H])C([H])=C2[H])C([H])=C1[H] |
CAS No. | 76907-79-4 |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | - |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | ABI Chem, |
Drug-Likeliness Filters | Lipinski's rule of five | Yes |
Ghose filter | Yes |
Veber filter | Yes |
Muegge Filter | Yes |
Similarity Search | Human metabolite database | FDA approved drugs |