(Q104939550)

English

[(2S,3S,4S,8S,9S,10S,11R)-3,10-dihydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] (Z)-2-methylbut-2-enoate

chemical compound

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instance of

type of chemical entity

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subclass of

(3,10-Dihydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

392.147117728 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(2R,3S,4R,8S,9S,10R,11R)-3,10-dihydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] (Z)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₄O₈

0 references

canonical SMILES

O=C(OC1C(O)C2(OC(=CC2=O)C(C)C(O)C3OC(=O)C(=C)C31)C)C(=CC)C

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isomeric SMILES

C=C1C(=O)O[C@@H]2[C@@H](O)[C@H](C)C3=CC(=O)[C@](C)(O3)[C@@H](O)[C@@H](OC(=O)/C(C)=C\C)[C@@H]12

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found in taxon

Trichogonia salviaefolia

1 reference

stated in

Neue Sesquiterpenlactone und Rosan-Derivate ausTrichogonia-Arten

Identifiers

InChI

InChI=1S/C20H24O8/c1-6-8(2)18(24)27-16-13-10(4)19(25)26-15(13)14(22)9(3)11-7-12(21)20(5,28-11)17(16)23/h6-7,9,13-17,22-23H,4H2,1-3,5H3/b8-6-/t9-,13+,14+,15+,16+,17+,20+/m1/s1

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InChIKey

BOSMSDXDJXIVAW-TXYGKKGISA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104939550)

[(2S,3S,4S,8S,9S,10S,11R)-3,10-dihydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] (Z)-2-methylbut-2-enoate

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