Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL564629

CUCURBITACIN R
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
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

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C30H46O7
MW 518.69
Aromatic Rings 0
Heavy Atoms 37
NP-Likeness 2.92

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