| Compound | Cucurbita-5,23(E)-diene-3-beta,7-beta,25-triol |
| NPACT-Id | NPACT00447 |
| IUPAC | [(E,6R)-6-[(2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-9-(hydroxymethyl)-4,4,13,14-tetramethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate |
| Synonyms | - |
| PubChem Id | 25016665 |
| Class | Terpenoids |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | FDINJVUVNVFMKX-NGPVLLJVSA-N |
| InChi | 1S/C30H50O3/c1-19(10-9-14-26(2,3)33)20-13-15-30(8)25-23(31)18-22-21(11-12-24(32)27(22,4)5)28(25,6)16-17-29(20,30)7/h9,14,18-21,23-25,31-33H,10-13,15-17H2,1-8H3/b14-9+/t19-,20-,21-,23+,24+,25-,28+,29-,30+/m1/s1 |
| SMILES | O[C@@H]1[C@H]2[C@]3([C@@]([C@H](CC3)[C@@H](C/C=C/C(O)(C)C)C)(CC[C@]2([C@H]2C(=C1)C([C@@H](O)CC2)(C)C)C)C)C |
|
SMART | [#6][C@H](CC=C[C@@](O)([#6])[#6])[C@H]1CC[C@@]2([#6])[C@@H]3[C@@H](O)C=C4[C@@H](CC[C@H](O)[C@@]4([#6])[#6])[C@]3([#6])CC[C@]12[#6] |
| CAS No. | - |
|
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 |