Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D00NOH
|
|||
| Former ID |
DIB018486
|
|||
| Drug Name |
15-deoxy-TIC
|
|||
| Synonyms |
15-deoxy-TIC; GTPL5865; SCHEMBL6085139; 5-[(3aS,5R,6R,6aS)-5-hydroxy-6-[(E)-4-(3-methylphenyl)but-1-enyl]-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoic acid; (3aS)-4beta-[(E)-4-(3-Methylphenyl)-1-butenyl]-5alpha-hydroxy-3,3abeta,4,5,6,6abeta-hexahydropentalene-2-pentanoic acid
Click to Show/Hide
|
|||
| Drug Type |
Small molecular drug
|
|||
| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL
|
||
| Formula |
C24H32O3
|
|||
| Canonical SMILES |
CC1=CC(=CC=C1)CCC=CC2C(CC3C2CC(=C3)CCCCC(=O)O)O
|
|||
| InChI |
1S/C24H32O3/c1-17-7-6-10-18(13-17)8-2-4-11-21-22-15-19(9-3-5-12-24(26)27)14-20(22)16-23(21)25/h4,6-7,10-11,13-14,20-23,25H,2-3,5,8-9,12,15-16H2,1H3,(H,26,27)/b11-4+/t20-,21+,22-,23+/m0/s1
|
|||
| InChIKey |
UZEWMXSWYKBMJG-ROHPBGETSA-N
|
|||
| PubChem Compound ID | ||||
| PubChem Substance ID | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5865). | |||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.