(Q105381575)

English

[(5R,6S,7S,11R,12S)-13-methyl-8-methylidene-3,9-dioxo-4,10-dioxatetracyclo[10.3.0.02,5.07,11]pentadeca-1,13-dien-6-yl] (E)-2-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(13-Methyl-8-methylidene-3,9-dioxo-4,10-dioxatetracyclo[10.3.0.02,5.07,11]pentadeca-1,13-dien-6-yl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

356.12598836 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(5S,6S,7S,11R,12S)-13-methyl-8-methylidene-3,9-dioxo-4,10-dioxatetracyclo[10.3.0.02,5.07,11]pentadeca-1,13-dien-6-yl] (Z)-2-methylbut-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₀O₆

0 references

canonical SMILES

O=C(OC1C2OC(=O)C2=C3CC=C(C)C3C4OC(=O)C(=C)C14)C(=CC)C

0 references

isomeric SMILES

C=C1C(=O)O[C@@H]2[C@H]3C(C)=CCC3=C3C(=O)O[C@H]3[C@@H](OC(=O)/C(C)=C/C)[C@@H]12

0 references

found in taxon

Campovassouria cruciata

1 reference

stated in

8β-Tigloylguaiagrazielolide from Campovassouria bupleurifolia

Identifiers

InChI

InChI=1S/C20H20O6/c1-5-8(2)18(21)25-16-13-10(4)19(22)24-15(13)12-9(3)6-7-11(12)14-17(16)26-20(14)23/h5-6,12-13,15-17H,4,7H2,1-3H3/b8-5+/t12-,13-,15+,16-,17+/m0/s1

0 references

InChIKey

ZQNXYIUWXMFILN-KDYYLDKASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZQNXYIUWXMFILN-KDYYLDKASA-N

(Q105381575)

[(5R,6S,7S,11R,12S)-13-methyl-8-methylidene-3,9-dioxo-4,10-dioxatetracyclo[10.3.0.02,5.07,11]pentadeca-1,13-dien-6-yl] (E)-2-methylbut-2-enoate

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