Compound | 3-beta,15-alpha-dihydroxy lanosta-7,9(11),24-triene-21-oic acid |
NPACT-Id | NPACT00114 |
IUPAC | - |
Synonyms | - |
PubChem Id | - |
Class | Terpenoids |
In-vitro anticancer activity | 10 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | VTFXYKFLDFEOFQ-IMPRGPNHSA-N |
InChi | 1S/C29H46O4/c1-17-7-14-28(24(31)32)15-9-21-27(6)12-8-19-25(3,4)22(30)11-13-26(19,5)20(27)10-16-29(21,33)23(28)18(17)2/h10,16-23,30,33H,7-9,11-15H2,1-6H3,(H,31,32)/t17-,18-,19-,20+,21-,22-,23-,26-,27+,28-,29+/m0/s1 |
SMILES | C1C[C@@H](C([C@@H]2[C@@H]1C1=CC[C@@]3([C@H](C[C@@H]([C@]3(C1=CC2)C)O)[C@@H](CCC=C(C)C)C(=O)O)C)(C)C)O |
SMART | [#6]C([#6])=C/CC[C@H]([C@H]1C[C@H](O)[C@@]2([#6])C3=CC[C@H]4[C@@H](CC[C@H](O)[C@]4([#6])[#6])C3=CC[C@]12[#6])C(O)=O |
CAS No. | 226406-72-0 |
|
Structure Download |
|
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 | No |
Veber filter | Yes |
Muegge Filter | Yes |
Similarity Search | Human metabolite database | FDA approved drugs |