Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0K6HL
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| Former ID |
DNC000501
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| Drug Name |
Cyclopiazonic acid
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| Synonyms |
2o9j; 2oa0; BSPBio_001303; GTPL5350; SCHEMBL1471247; MolPort-003-983-745; BS0055; ZINC100061481; ZINC100067111; ZINC110970687; FT-0624278; J-011619; (2R,3S,9R)-5-acetyl-4-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0^{2,9}.0^{3,7}.0^{15,18}]octadeca-1(17),4,11(18),12,14-pentaen-6-one
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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 |
C20H20N2O3
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| Canonical SMILES |
CC(=O)C1=C(C2C3C(CC4=C5C3=CNC5=CC=C4)C(N2C1=O)(C)C)O
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| InChI |
1S/C20H20N2O3/c1-9(23)14-18(24)17-16-11-8-21-13-6-4-5-10(15(11)13)7-12(16)20(2,3)22(17)19(14)25/h4-6,8,12,16-17,21,24H,7H2,1-3H3/t12-,16+,17+/m1/s1
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| InChIKey |
SZINUGQCTHLQAZ-DQYPLSBCSA-N
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| CAS Number |
CAS 18172-33-3
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| PubChem Compound ID | ||||
| PubChem Substance ID |
5937, 14924614, 14924618, 15471035, 26756478, 26756479, 29214828, 29214846, 43122083, 47885121, 50040340, 50111372, 50522756, 53812822, 53812824, 57309856, 57315403, 91746482, 92309719, 99300633, 99444075, 103609683, 104333307, 119501664, 119503394, 124389650, 135023133, 135165282, 137156487, 137251510, 160968674, 162022867, 162221141, 164808268, 175607729, 178102012, 179113940, 184548392, 198943370, 227678737, 240011060, 241182257, 241375312, 252455443
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Sarcoplasmic/endoplasmic reticulum calcium ATPase (ATP2A) | Target Info | Inhibitor | [2] |
| 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: 5350). | |||
| REF 2 | Expression and functional characterization of a Plasmodium falciparum Ca2+-ATPase (PfATP4) belonging to a subclass unique to apicomplexan organisms. J Biol Chem. 2001 Apr 6;276(14):10782-7. | |||
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