CHEBI:138037 - 10-epi-juneol

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 10-epi-juneol ChEBI ID CHEBI:138037 ChEBI ASCII Name 10-epi-juneol Definition A eudesmane sesquiterpenoid that is 4a-methyl-8-methylidene-decahydronaphthalene carrying additional hydroxy and isopropyl substituents at positions 1 and 2 respectively (the 1S,2S,4aS,8aS-diastereomer). Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information eMolecules:1745254, ZINC000000529951 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C15H26O Net Charge 0 Average Mass 222.367 Monoisotopic Mass 222.19837 InChI InChI=1S/C15H26O/c1-10(2)12-7-9-15(4)8-5-6-11(3)13(15)14(12)16/h10,12-14,16H,3,5-9H2,1-2,4H3/t12-,13+,14-,15-/m0/s1 InChIKey MSJJKJCIFIGTJY-XGUBFFRZSA-N SMILES C1CCC([C@]2([C@@]1(CC[C@H]([C@@H]2O)C(C)C)C)[H])=C ChEBI Ontology Outgoing 10-epi-juneol (CHEBI:138037) is a eudesmane sesquiterpenoid (CHEBI:62508) 10-epi-juneol (CHEBI:138037) is a homoallylic alcohol (CHEBI:134362) 10-epi-juneol (CHEBI:138037) is a secondary alcohol (CHEBI:35681) IUPAC Name (1S,2S,4aS,8aS)-4a-methyl-8-methylidene-2-(propan-2-yl)decahydronaphthalen-1-ol Synonyms Sources (1S,2S,4aS,8aS)-2-isopropyl-4a-methyl-8-methylidenedecahydronaphthalen-1-ol ChEBI 10-epi-juneol UniProt 10-epijuneol ChEBI Manual Xrefs Databases CPD-20137 MetaCyc HMDB0034982 HMDB View more database links Registry Number Type Source 1951940 Reaxys Registry Number Reaxys Citation Type Source 27231873 PubMed citation SUBMITTER Last Modified 05 October 2017