(3S,3aR,5R,6S,7aR)-6-ethenyl-3,6-dimethyl-5-[(2S)-2-methyloxiran-2-yl]-3,3a,4,5,7,7a-hexahydro-1-benzofuran-2-one

chemical compound

Wikidata entity: Q105208266

C₁₅H₂₂O₃ (P274)



Quantities

P2067mass250.156894564

P233 canonical SMILES String O=C1OC2CC(C=C)(C)C(CC2C1C)C3(OC3)C ???
P703 found in taxon ... Q10933928 (Inula grandis) Inula grandis
P703 found in taxon ... Q12849140 (Inula macrophylla) Inula macrophylla
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String C=C[C@]1(C)C[C@H]2OC(=O)[C@@H](C)[C@H]2C[C@H]1[C@@]1(C)CO1 ???
P3364 stereoisomer of ... Q105208265 ((3S,3aR,5R,6R,7aR)-6-ethenyl-3,6-dimethyl-5-[(2S)-2-methyloxiran-2-yl]-3,3a,4,5,7,7a-hexahydro-1-benzofuran-2-one) (3S,3aR,5R,6R,7aR)-6-ethenyl-3,6-dimethyl-5-[(2S)-2-methyloxiran-2-yl]-3,3a,4,5,7,7a-hexahydro-1-benzofuran-2-one
P279 subclass of ... Q105208267 (6-Ethenyl-3,6-dimethyl-5-(2-methyloxiran-2-yl)-3,3a,4,5,7,7a-hexahydro-1-benzofuran-2-one) 6-Ethenyl-3,6-dimethyl-5-(2-methyloxiran-2-yl)-3,3a,4,5,7,7a-hexahydro-1-benzofuran-2-one

External Ids
P234InChIInChI=1S/C15H22O3/c1-5-14(3)7-11-10(9(2)13(16)18-11)6-12(14)15(4)8-17-15/h5,9-12H,1,6-8H2,2-4H3/t9-,10+,11+,12+,14+,15+/m0/s1
P235InChIKeyPGAGLALAWDEWBB-RWBGOSSDSA-N
P662PubChem CID163024385

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