Compound | Olean-12-en-3-alpha,24-diol |
NPACT-Id | NPACT00827 |
IUPAC | 4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-ol |
Synonyms | - |
PubChem Id | 14167252 |
Class | Terpenoids |
In-vitro anticancer activity | 3 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | NTWLPZMPTFQYQI-UHFFFAOYSA-N |
InChi | 1S/C30H50O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,21-24,31-32H,9-19H2,1-7H3 |
SMILES | O[C@H]1[C@@]([C@@H]2[C@]([C@H]3[C@@]([C@@]4(C(=CC3)[C@H]3[C@](CC4)(CCC(C3)(C)C)C)C)(CC2)C)(CC1)C)(CO)C |
SMART | [#6][C@@]1([#6])CC[C@@]2([#6])CC[C@@]3([#6])C(=CC[C@H]4[C@]5([#6])CC[C@@H](O)[C@]([#6])(CO)[C@H]5CC[C@]34[#6])[C@@H]2C1 |
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 | No |
Ghose filter | No |
Veber filter | Yes |
Muegge Filter | No |
Similarity Search | Human metabolite database | FDA approved drugs |