(Q105297443)

English

[(3aR,4S,6E,9Z,11R,11aS)-11-hydroxy-6,10-dimethyl-3-methylidene-2,8-dioxo-4,5,11,11a-tetrahydro-3aH-cyclodeca[b]furan-4-yl] (E)-2-methylbut-2-enoate

chemical compound

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instance of

type of chemical entity

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subclass of

(11-hydroxy-6,10-dimethyl-3-methylidene-2,8-dioxo-4,5,11,11a-tetrahydro-3aH-cyclodeca[b]furan-4-yl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

360.157288488 dalton

1 reference

1 reference

C₂₀H₂₄O₆

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canonical SMILES

O=C(OC1CC(=CC(=O)C=C(C)C(O)C2OC(=O)C(=C)C12)C)C(=CC)C

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isomeric SMILES

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

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found in taxon

Elephantopus mollis

1 reference

stated in

Antitumor agents XXXVIII: Isolation and structural elucidation of novel germacranolides and triterpenes from Elephantopus mollis

Identifiers

InChI

InChI=1S/C20H24O6/c1-6-11(3)19(23)25-15-8-10(2)7-14(21)9-12(4)17(22)18-16(15)13(5)20(24)26-18/h6-7,9,15-18,22H,5,8H2,1-4H3/b10-7+,11-6+,12-9-/t15-,16+,17+,18-/m0/s1

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InChIKey

VUURQISRHJCAJY-QDJZJPPGSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

VUURQISRHJCAJY-QDJZJPPGSA-N

1 reference

(Q105297443)

[(3aR,4S,6E,9Z,11R,11aS)-11-hydroxy-6,10-dimethyl-3-methylidene-2,8-dioxo-4,5,11,11a-tetrahydro-3aH-cyclodeca[b]furan-4-yl] (E)-2-methylbut-2-enoate

Statements

Identifiers

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