Compound | 13(R)-14(R)-hydroxyantofine-N-oxide |
NPACT-Id | NPACT01423 |
IUPAC | (13aR,14R)-2,3,6-trimethoxy-10-oxido-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizin-10-ium-14-ol |
Synonyms | - |
PubChem Id | 11741391 |
Class | Alkaloids |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | LDYKNAJDTNPEPC-DHFLCVKNSA-N |
InChi | 1S/C23H25NO5/c1-27-13-6-7-14-15(9-13)16-10-20(28-2)21(29-3)11-17(16)22-18(14)12-24(26)8-4-5-19(24)23(22)25/h6-7,9-11,19,23,25H,4-5,8,12H2,1-3H3/t19-,23+,24?/m1/s1 |
SMILES | [O-][N+]12[C@H](CCC1)[C@H](O)c1c(C2)c2c(c3c1cc(OC)c(OC)c3)cc(OC)cc2 |
SMART | [#6]OC1=CC2=C(C=C1)C1=C([C@@H](O)[C@H]3CCC[N+]3([O-])C1)C1=CC(O[#6])=C(O[#6])C=C21 |
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 |