Subspicatin E

chemical compound

Wikidata entity: Q105200850

C₂₀H₂₈O₆ (P274)



Quantities

P2067mass364.188588616

P233 canonical SMILES String O=C(OC1CCC(C)C2(C)C(O)C34OC4(OC(=O)C3C)CC12)C(=CC)C ???
P703 found in taxon ... Q15231274 (Ligularia lamarum) Ligularia lamarum
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String C/C=C(/C)C(=O)O[C@@H]1CC[C@H](C)[C@@]2(C)[C@H](O)[C@@]34O[C@]3(C[C@@H]12)OC(=O)[C@@H]4C ???
P3364 stereoisomer of ... Q105200852 ((Z)-2-Methyl-2-butenoic acid (3S)-4beta-hydroxy-3beta,4abeta,5beta-trimethyl-2-oxo-3abeta,9abeta-epoxy-2,3,3a,4,4a,5,6,7,8,8abeta,9,9a-dodecahydronaphtho[2,3-b]furan-8beta-yl ester) (Z)-2-Methyl-2-butenoic acid (3S)-4beta-hydroxy-3beta,4abeta,5beta-trimethyl-2-oxo-3abeta,9abeta-epoxy-2,3,3a,4,4a,5,6,7,8,8abeta,9,9a-dodecahydronaphtho[2,3-b]furan-8beta-yl ester
P279 subclass of ... Q105200851 ((2-Hydroxy-3,4,13-trimethyl-12-oxo-11,14-dioxatetracyclo[8.3.1.01,10.03,8]tetradecan-7-yl) 2-methylbut-2-enoate) (2-Hydroxy-3,4,13-trimethyl-12-oxo-11,14-dioxatetracyclo[8.3.1.01,10.03,8]tetradecan-7-yl) 2-methylbut-2-enoate

External Ids
P234InChIInChI=1S/C20H28O6/c1-6-10(2)15(21)24-14-8-7-11(3)18(5)13(14)9-19-20(26-19,17(18)23)12(4)16(22)25-19/h6,11-14,17,23H,7-9H2,1-5H3/b10-6-/t11-,12-,13-,14+,17-,18+,19-,20+/m0/s1
P235InChIKeyOVMSUOGTJXIEKB-PSBVQIIFSA-N
P662PubChem CID101780478
P11089UniChem compound ID101128040

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