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

CHEMBL465480

JABOROSALACTONE D
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
CC1=C(CO)C(=O)O[C@@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@@H](O)[C@@]5(O)CC=CC(=O)[C@]5(C)[C@H]4CC[C@]23C)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL465480
Name JABOROSALACTONE D
Phase Preclinical
Structure Type MOL
InChI Key LDWRZKAVHDHGID-VZGLNVPESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

472.6
MW (Da)
3.34
ALogP
6
HBA
3
HBD
104.1
PSA (Ų)
0.54
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C28H40O6
MW 472.62
Aromatic Rings 0
Heavy Atoms 34
NP-Likeness 3.72

Literature References

PubMed DOI Target Context # Activities
12027740 10.1021/np0106337 Unchecked 2
12027740 10.1021/np0106337 Quinone oxidoreductase 2
12027740 10.1021/np0106337 ADMET 1
- 10.3390/50300422 Spodoptera littoralis 1
24625088 10.1021/jm401279n NON-PROTEIN TARGET 1
24625088 10.1021/jm401279n Heat shock 70 kDa protein 6 1

Data from ChEMBL 36 via Core Engine