General Information of the Compound
| Compound ID |
CP0089986
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
STEPHOLIDINE
Show/Hide
|
||||||||||||||||||
| Synonyms |
(-)-Stepholidine
(13aS)-3,9-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,10-diol
(S)-3,9-Dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[3,2-a]isoquinoline-2,10-diol
0UPX3E69W8
13a-alpha-BERBINE-2,10-DIOL, 3,9-DIMETHOXY-
16562-13-3
3,9-Dimethoxy-13a-alpha-berbine-2,10-diol
AC1OCEV4
CHEMBL487387
DIB014
GTPL8370
L-(S)-Stepholidine
Q-100198
S-Stepholidine
SCHEMBL10001966
STEPHOLIDINE
UNII-0UPX3E69W8
l-2,10-Dihydroxy-3,9-dimethyloxytetrahydropseudoberberine
l-SPD
l-Stepholidine
stepholidine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H21NO4
|
||||||||||||||||||
| Molecular Weight |
327.38
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2CCN3Cc4c(C[C@H]3c2cc1O)ccc(O)c4OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H21NO4/c1-23-18-8-12-5-6-20-10-14-11(3-4-16(21)19(14)24-2)7-15(20)13(12)9-17(18)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3/t15-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
JKPISQIIWUONPB-HNNXBMFYSA-N
|
||||||||||||||||||
| 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
Protein ID: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT01195, D(1A) dopamine receptor
Cell-based Assay
Protein ID: PT01169, D(1B) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor
Cell-based Assay
Protein ID: PT01366, D(3) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor
Protein ID: PT01039, Tissue factor
Clinical Information about the Compound