CHEBI:8 - (+)-8-hydroxycalamenene

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ChEBI Name (+)-8-hydroxycalamenene ChEBI ID CHEBI:8 Definition A sesquiterpenoid consisting of 5,6,7,8-tetrahydronaphthalen-1-ol having two methyl substituents at the 3- and 8-positions, an isopropyl substituent at the 5-position and (+)-(5R,8S)-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 C15H22O Net Charge 0 Average Mass 218.33458 Monoisotopic Mass 218.16707 InChI InChI=1S/C15H22O/c1-9(2)12-6-5-11(4)15-13(12)7-10(3)8-14(15)16/h7-9,11-12,16H,5-6H2,1-4H3/t11-,12+/m0/s1 InChIKey FDMKIGKOMRSCAW-NWDGAFQWSA-N SMILES CC(C)[C@H]1CC[C@H](C)c2c(O)cc(C)cc12 ChEBI Ontology Outgoing (+)-8-hydroxycalamenene (CHEBI:8) has parent hydride cadinane (CHEBI:36513) (+)-8-hydroxycalamenene (CHEBI:8) is a carbobicyclic compound (CHEBI:36785) (+)-8-hydroxycalamenene (CHEBI:8) is a sesquiterpenoid (CHEBI:26658) IUPAC Names (5R,8S)-3,8-dimethyl-5-(propan-2-yl)-5,6,7,8-tetrahydronaphthalen-1-ol 7βH-cadina-1,3,5-trien-2-ol Synonyms Sources (+)-8-Hydroxycalamenene KEGG COMPOUND (+)-hydroxycalamenene ChEBI Manual Xrefs Databases C00002996 KNApSAcK C09938 KEGG COMPOUND LMPR0103330006 LIPID MAPS View more database links Registry Numbers Types Sources 4671990 Reaxys Registry Number Reaxys 5257045 Beilstein Registry Number Beilstein 88642-92-6 CAS Registry Number KEGG COMPOUND Last Modified 28 July 2014