General Information of the Compound
| Compound ID |
CP0770848
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Pelargonidin
Show/Hide
|
||||||||||||||||||
| Synonyms |
1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-, chloride
134-04-3
2-(4-hydroxyphenyl)chromenylium-3,5,7-triol chloride
3,4',5,7-Tetrahydroxyflavylium chloride
3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium chloride
3,5,7-Trihydroxy-2-(4-hydroxyphenyl)benzopyrylium chloride
3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromenylium chloride
C15H11O5.Cl
CHEBI:28510
CHEMBL591036
DFL6200791
EINECS 205-127-7
PELARGONIDIN CHLORIDE
Pelargonidin
Pelargonidin chloride
Pelargonidol chloride
UNII-DFL6200791
pelargonidine chloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H11ClO5
|
||||||||||||||||||
| Molecular Weight |
306.701
|
||||||||||||||||||
| Canonical SMILES |
Oc1ccc(-c2[o+]c3cc(O)cc(O)c3cc2O)cc1.[Cl-]
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H10O5.ClH/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15;/h1-7H,(H3-,16,17,18,19);1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
YPVZJXMTXCOTJN-UHFFFAOYSA-N
|
||||||||||||||||||
| CAS |
134-04-3
7690-51-9
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound