Compound | Orientanol c |
NPACT-Id | NPACT01287 |
IUPAC | - |
Synonyms | - |
PubChem Id | 42607512 |
Class | Flavonoid |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | MWXSRUJUWMLCJD-RPBOFIJWSA-N |
InChi | 1S/C25H26O6/c1-14(2)5-6-16-19(26)8-7-17-22(16)31-25(28)18-11-15-9-10-23(3,4)30-20(15)12-21(18)29-13-24(17,25)27/h5,7-12,26-28H,6,13H2,1-4H3/t24-,25+/m1/s1 |
SMILES | O1[C@]2(O)[C@](O)(c3c1c(c(O)cc3)CC=C(C)C)COc1c2cc2c(OC(C=C2)(C)C)c1 |
SMART | [H]OC1=C(C2=C(C([H])=C1[H])[C@]1(O[H])C([H])([H])OC3=C(C([H])=C4C([H])=C([H])[C@](OC4=C3[H])(C([H])([H])[H])C([H])([H])[H])[C@]1(O[H])O2)C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H] |
CAS No. | - |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | - |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | NA, |
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 |