Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D07GHW
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| Former ID |
DIB019002
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| Drug Name |
bongkrek acid
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| Synonyms |
bongkrekic acid; flavotoxin A
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL
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| Formula |
C28H38O7
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| Canonical SMILES |
CC(CC=CCCC=CC=CCC(C(=CC=C(C)C(=O)O)C)OC)C=CC(=CC(=O)O)CC(=O)O
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| InChI |
1S/C28H38O7/c1-21(15-18-24(19-26(29)30)20-27(31)32)13-11-9-7-5-6-8-10-12-14-25(35-4)22(2)16-17-23(3)28(33)34/h6,8-12,15-19,21,25H,5,7,13-14,20H2,1-4H3,(H,29,30)(H,31,32)(H,33,34)/b8-6+,11-9+,12-10-,18-15+,22-16-,23-17+,24-19+/t21-,25+/m0/s1
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| InChIKey |
SHCXABJSXUACKU-WUTQZGRKSA-N
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| CAS Number |
CAS 11076-19-0
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| PubChem Compound ID | ||||
| PubChem Substance ID | ||||
| ChEBI ID |
CHEBI:77742
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Adenine nucleotide translocator 1 (SLC25A4) | Target Info | Inhibitor | [2] |
| KEGG Pathway | Calcium signaling pathway | |||
| cGMP-PKG signaling pathway | ||||
| Parkinson's disease | ||||
| Huntington's disease | ||||
| HTLV-I infection | ||||
| Pathwhiz Pathway | Mitochondrial Electron Transport Chain | |||
| Reactome | Mitochondrial protein import | |||
| Regulation of insulin secretion | ||||
| WikiPathways | SIDS Susceptibility Pathways | |||
| Host Interactions of HIV factors | ||||
| Synaptic Vesicle Pathway | ||||
| Integration of energy metabolism | ||||
| Electron Transport Chain | ||||
| 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: 4689). | |||
| REF 2 | 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. (Target id: 1062). | |||
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