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Accepted by ToxBank	no +
Accepted by ToxCast	yes +
Equivalent URIThis property is a special property in this wiki.	http://bio2rdf.org/drugbank_drugs:APRD00104 +, http://bio2rdf.org/cas:79902-63-9 +, http://www.chemspider.com/Chemical-Structure.49179.rdf +, http://bio2rdf.org/pubchem:54454 +, http://bio2rdf.org/dr:D00434 +, http://rdf.openmolecules.net/?InChI=1S/C25H38O5/c1-6-25%284%2C5%2924%2828%2930-21-12-15%282%2911-17-8-7-16%283%2920%2823%2817%2921%2910-9-19-13-18%2826%2914-22%2827%2929-19/h7-8%2C11%2C15-16%2C18-21%2C23%2C26H%2C6%2C9-10%2C12-14H2%2C1-5H3/t15-%2C16-%2C18% +
Has CAS	79902-63-9 +
Has ChEMBL Id	1064 +
Has ChemSpider Id	49179 +
Has DrugBank Id	APRD00104 +
Has InChI	InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1 +
Has InChIKey	RYMZZMVNJRMUDD-HGQWONQESA-N +
Has KEGG Id	D00434 +
Has Leadscope Id	LS-46264 +
Has Open-TG-Gate Id	00117 +
Has PubChem CID	54454 +
Has Smiles	C1[C@H](OC(=O)C[C@@H]1O)CC[C@@H]1[C@H]2[C@@H](OC(C(CC)(C)C)=O)C[C@@H](C)C=C2C=C[C@@H]1C +
Has category	Hepatotoxic +
Has image	Simvastatin.png +
Has target	HMG-CoA reductase +
Has toxic effect	Apoptosis +
Modification dateThis property is a special property in this wiki.	21 March 2012 08:31:52 +
Categories	ApoptosisCausingCompounds, HepatotoxicCompounds, GoldCompounds

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