CHEBI:141821 - 15,16-epoxydolabrene

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ChEBI Name 15,16-epoxydolabrene ChEBI ID CHEBI:141821 Definition A tricyclic diterpenoid that is dolabradiene in which vinyl substituent has undergone oxidation to give the corresponding epoxide. 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 C20H32O Net Charge 0 Average Mass 288.468 Monoisotopic Mass 288.24532 InChI InChI=1S/C20H32O/c1-14-6-5-7-16-19(14,3)9-8-15-12-18(2,17-13-21-17)10-11-20(15,16)4/h15-17H,1,5-13H2,2-4H3/t15-,16-,17?,18+,19-,20-/m1/s1 InChIKey MDUIQYUVECBDRX-LBNFNQNDSA-N SMILES [C@@]12([C@]3([C@](CC[C@@]1(C[C@@](CC2)(C)C4CO4)[H])(C(CCC3)=C)C)[H])C ChEBI Ontology Outgoing 15,16-epoxydolabrene (CHEBI:141821) has functional parent dolabradiene (CHEBI:141822) 15,16-epoxydolabrene (CHEBI:141821) is a epoxide (CHEBI:32955) 15,16-epoxydolabrene (CHEBI:141821) is a olefinic compound (CHEBI:78840) 15,16-epoxydolabrene (CHEBI:141821) is a tricyclic diterpenoid (CHEBI:79084) Incoming 3β-hydroxy-15,16-epoxydolabrene (CHEBI:141820) has functional parent 15,16-epoxydolabrene (CHEBI:141821) IUPAC Name (2Ξ)-2-[(2S,4aR,4bS,8aS,10aR)-2,4a,8a-trimethyl-8-methylenetetradecahydrophenanthren-2-yl]oxirane Synonym Source 15,16-epoxydolabrene UniProt Manual Xref Database CPD-21266 MetaCyc View more database links Citation Type Source 29475898 PubMed citation SUBMITTER Last Modified 05 October 2018