CHEBI:138167 - 5-hydroxy-α-gurjunene

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ChEBI Name 5-hydroxy-α-gurjunene ChEBI ID CHEBI:138167 ChEBI ASCII Name 5-hydroxy-alpha-gurjunene Definition A tricyclic sesquiterpenoid obtained by formal hydration across the endocyclic double bond of (−)-α-gurjunene Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen 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 C15H26O Net Charge 0 Average Mass 222.367 Monoisotopic Mass 222.19837 InChI InChI=1S/C15H26O/c1-9-5-7-12-13(14(12,3)4)15(16)10(2)6-8-11(9)15/h9-13,16H,5-8H2,1-4H3/t9-,10?,11-,12-,13+,15?/m1/s1 InChIKey OHFMYRJCMYNZKO-KUKPGQNJSA-N SMILES [C@]12(CC[C@H]([C@@]3(C([C@@]1(C2(C)C)[H])(C(CC3)C)O)[H])C)[H] ChEBI Ontology Outgoing 5-hydroxy-α-gurjunene (CHEBI:138167) has functional parent (−)-α-gurjunene (CHEBI:61699) 5-hydroxy-α-gurjunene (CHEBI:138167) is a carbotricyclic compound (CHEBI:38032) 5-hydroxy-α-gurjunene (CHEBI:138167) is a sesquiterpenoid (CHEBI:26658) 5-hydroxy-α-gurjunene (CHEBI:138167) is a tertiary alcohol (CHEBI:26878) IUPAC Name (1aR,4R,4aR,7bS)-1,1,4,7-tetramethyldecahydro-7aH-cyclopropa[e]azulen-7a-ol Synonym Source 5-hydroxy-α-gurjunene UniProt Manual Xref Database CPD-20252 MetaCyc View more database links Citation Type Source 27650333 PubMed citation SUBMITTER Last Modified 24 October 2017