(Q105158859)

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] 2-methylprop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

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

1 reference

based on heuristic

inferred from SMILES

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

1 reference

based on heuristic

inferred from SMILES

mass

346.141638424 dalton

1 reference

1 reference

C₁₉H₂₂O₆

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canonical SMILES

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

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isomeric SMILES

C=C(C)C(=O)O[C@H]1C/C(C)=C/C(=O)/C=C(/C)[C@@H](O)[C@H]2OC(=O)C(=C)[C@H]12

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found in taxon

Elephantopus mollis

2 references

stated in

New sesquiterpene lactones from Elephantopus mollis and their leishmanicidal activities

stated in

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

Identifiers

InChI

InChI=1S/C19H22O6/c1-9(2)18(22)24-14-7-10(3)6-13(20)8-11(4)16(21)17-15(14)12(5)19(23)25-17/h6,8,14-17,21H,1,5,7H2,2-4H3/b10-6+,11-8-/t14-,15+,16+,17-/m0/s1

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InChIKey

LXINRHXYVUTAMQ-XTLRTUJBSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LXINRHXYVUTAMQ-XTLRTUJBSA-N

1 reference

(Q105158859)

[(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] 2-methylprop-2-enoate

Statements

Identifiers

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