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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL510508
CHEMBL510508
Compound Name PHLOROFUCOFUROECKOL A
ChEMBL Synonyms PHLOROFUCOFUROECKOL A
Max Phase 0
Trade Names
Molecular Formula C30H18O14

Additional synonyms for CHEMBL510508 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Oc1cc(O)cc(Oc2c(O)cc(O)c3Oc4c(Oc23)c(O)cc5oc6c(Oc7cc(O)cc(O) ...
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Standard InChI InChI=1S/C30H18O14/c31-10-1-11(32)4-14(3-10)40-24-17(36)7-16 ...
Download InChI
Standard InChI Key SLWPBUMYPRVYIJ-UHFFFAOYSA-N

Alternate Forms of Compound in ChEMBL


CHEMBL510508

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
602.5 602.0697 5.57 4 232.12 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
13 9 4 14 9 3


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
7.37 - 7.53 7.19 6 44 0.12

Structural Alerts

There are 3 structural alerts for CHEMBL510508. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:SLWPBUMYPRVYIJ-UHFFFAOYSA-N
Wikipedia Phlorofucofuroeckol_A

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL510508



ACToR 128129-56-6
BindingDB 50276756
EPA CompTox Dashboard DTXSID40155821
Nikkaji J797.611I
PubChem 130976
PubChem: Thomson Pharma 14789363
SureChEMBL SCHEMBL2230693

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/SLWPBUMYPRVYIJ-UHFFFAOYSA-N spacer
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