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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL501637
CHEMBL501637
Compound Name GINSENOSIDE RG1
ChEMBL Synonyms Ginsenoside Rg1
Max Phase 0
Trade Names
Molecular Formula C42H72O14

Additional synonyms for CHEMBL501637 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC(=CCC[C@](C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C ...
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Standard InChI InChI=1S/C42H72O14/c1-20(2)10-9-13-42(8,56-37-34(52)32(50)30 ...
Download InChI
Standard InChI Key YURJSTAIMNSZAE-HHNZYBFYSA-N

Structural Alerts

There are 7 structural alerts for CHEMBL501637. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL501637

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
801 800.4922 1.13 10 239.21 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
14 10 3 14 10 2


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
12.91 - 1.5 1.5 0 56 0.11

Compound Cross References

ChemSpider ChemSpider:YURJSTAIMNSZAE-HHNZYBFYSA-N
Wikipedia Ginsenoside

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL501637



ACToR 22427-39-0
ChEBI 67987
eMolecules 30512691 26754408
IBM Patent System 42458817DA9E80FA11AA21D4E80BC4EB
IBM Patents US7205005 EP1745060A2 US20080292607 US20060024385 EP2037948A2 WO2006124012A2 US20020110606 EP1351698A2 EP2152281A2 US20090208470 US20100298394 US6692777 EP2243486A1 US20090155377 US20080275225 US20080279882 US4783454 US20070104728 US20100221365 US20080254152 WO2001091586A2 WO2006026284A2 WO2005020672A1 WO2004056379A1 EP1006802A1 WO2006118630A2 US6793944 US20060105067 US20100056617 EP1388344A1 US20030087835 WO2006011691A1 WO2004069263A1 US20050031711 WO2005016362A1 US6440450 EP1170012A1 US20020058805 US20100276820 US20030190378 EP1559429A2 US20070191477 EP1905444A1 EP2251008A1 WO2005113656A1 WO2008147141A1 EP0831864A1 US20060051435 EP1658879A1 US20100297270 US20060068045 EP0283713A2 EP0809484B1 WO2008021861A2 US20050226908 WO2008124131A1 US7858313 EP2139506A1 EP0201784A2 US7807398 EP1374880A1 US20100028467 EP1454918A1 US6805799 US20100150895 US20050025843 WO2008138095A1 US20080207480 WO2010053271A2 US20080113925 US20100041562 US20040202730 US20100310683 WO2009063872A1 US7198804 WO2002047704A1 US20060003947 EP0912599B1 WO2008133563A1 WO2007143652A2 EP1071396A1 WO1993013754A1 US4795742 WO2005120536A1 WO2004058141A2 EP1940434A2 US7396545 EP1948781B1 US20070053999 WO2005034963A1 US20050020535 US20050266143 US6338862 WO2010081869A1 US20090093854 EP1906944A1 US20070275103 WO2001001816A1 US6444218 EP1841460A2
KEGG Ligand C08946
Nikkaji J15.784H
PubChem 441923
PubChem: Thomson Pharma 14840598 56268526

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