CHEBI:61680 - (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene

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ChEBI Name (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene ChEBI ID CHEBI:61680 ChEBI ASCII Name (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene Definition An ortho-fused bicyclic hydrocarbon with a structure consisting of decalin hydrogenated across C(7)‒C(8) and with methyl groups at C(1) and C(4a) which both have S configuration. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H20 Net Charge 0 Average Mass 164.28720 Monoisotopic Mass 164.15650 InChI InChI=1S/C12H20/c1-10-6-5-9-12(2)8-4-3-7-11(10)12/h3,7,10-11H,4-6,8-9H2,1-2H3/t10-,11?,12+/m0/s1 InChIKey HDVGBFCTHLFNEE-ASKATJPDSA-N SMILES C[C@H]1CCC[C@@]2(C)CCC=CC12 ChEBI Ontology Outgoing (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene (CHEBI:61680) is a ortho-fused bicyclic hydrocarbon (CHEBI:35428) (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene (CHEBI:61680) is a octahydronaphthalenes (CHEBI:138397) IUPAC Name (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene Synonym Source (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene UniProt Registry Number Type Source 10427599 Reaxys Registry Number Reaxys Citation Type Source 16787064 PubMed citation Europe PMC Last Modified 07 September 2017