Compound Detail
CHEMBL564629
CUCURBITACIN R Enter ChEMBL ID:
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CC(C)(O)CCC(=O)[C@](C)(O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C
Basic Information
| ChEMBL ID | CHEMBL564629 |
| Name | CUCURBITACIN R |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ITMUUFDDBRYVNJ-VOKXYEOFSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
518.7
MW (Da)
3.15
ALogP
7
HBA
4
HBD
132.1
PSA (Ų)
0.41
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7852999 | 10.1021/np50113a004 | JY | 5 |
| 7852999 | 10.1021/np50113a004 | Unchecked | 3 |
| 7852999 | 10.1021/np50113a004 | Protein kinase C (PKC) | 1 |
| 7852999 | 10.1021/np50113a004 | Integrin alpha-L | 1 |
| 19348465 | 10.1021/np800692t | A549 | 1 |
| 19348465 | 10.1021/np800692t | Bel-7402 | 1 |
| 19348465 | 10.1021/np800692t | Signal transducer and activator of transcription 3 | 1 |
| 33269591 | 10.1021/acs.jnatprod.0c00364 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine