CHEBI:138046 - sesterfisherol

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ChEBI Name sesterfisherol ChEBI ID CHEBI:138046 Definition A tetracyclic sesterterpenoid obtained by by expressing a small gene cluster consisting of a terpene synthase (Nf SS) and a cytochrome P450 monooxygenase (Nf P450). 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 C25H42O Net Charge 0 Average Mass 358.610 Monoisotopic Mass 358.32357 InChI InChI=1S/C25H42O/c1-15(2)19-11-12-24(6)13-22-17(4)8-9-20-16(3)7-10-21(20)18(5)25(22,26)14-23(19)24/h15-17,19-20,22-23,26H,7-14H2,1-6H3/b21-18-/t16-,17+,19-,20+,22-,23+,24-,25+/m1/s1 InChIKey VQMHZILKNHUAMP-AISFCYSSSA-N SMILES [H][C@@]12CC[C@H](C)[C@@]3([H])C[C@@]4(C)CC[C@H](C(C)C)[C@]4([H])C[C@]3(O)\C(C)=C1\CC[C@H]2C ChEBI Ontology Outgoing sesterfisherol (CHEBI:138046) is a carbopolycyclic compound (CHEBI:35294) sesterfisherol (CHEBI:138046) is a sesterterpenoid (CHEBI:26660) sesterfisherol (CHEBI:138046) is a tertiary allylic alcohol (CHEBI:134397) IUPAC Name (3R,3aS,6S,6aR,7aR,10R,10aS,11aR,12Z)-3,6,7a,12-tetramethyl-10-(propan-2-yl)-2,3,3a,4,5,6,6a,7,7a,8,9,10,10a,11-tetradecahydrocyclopenta[4,5]cycloocta[1,2-f]inden-11a(1H)-ol Synonym Source sesterfisherol UniProt Manual Xref Database CPD-20216 MetaCyc View more database links Registry Number Type Source 28692819 Reaxys Registry Number Reaxys Citation Type Source 26332841 PubMed citation SUBMITTER Last Modified 03 August 2020