(Q105193873)

English

[(2R)-2-[4-methyl-2-(2-methylpropanoyloxy)phenyl]oxiran-2-yl]methyl 2-methylpropanoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

Bis(2-methylpropanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene

1 reference

based on heuristic

inferred from SMILES

mass

320.162373868 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₄O₅

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canonical SMILES

O=C(OC1=CC(=CC=C1C2(OC2)COC(=O)C(C)C)C)C(C)C

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isomeric SMILES

Cc1ccc([C@]2(COC(=O)C(C)C)CO2)c(OC(=O)C(C)C)c1

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found in taxon

Arnica amplexicaulis

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stated in

Neue thymol-derivative aus arnica amplexicaulis

Arnica lanceolata

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stated in

Neue thymol-derivative aus arnica amplexicaulis

Ligularia amplexicaulis

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stated in

Neue thymol-derivative aus arnica amplexicaulis

Arnica sachalinensis

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stated in

10-acetoxy-9-chloro-8,9-dehydrothymol and further thymol derivatives from Arnica sachalinensis

Calea szyszylowiczii

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stated in

Germacranolide und Eudesmanolide ausCalea szyszylowiczii

Calea villosa

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stated in

Three furanoheliangolides from Calea villosa

Dittrichia graveolens

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stated in

Further sesquiterpene lactones from the genus Dittrichia

Dittrichia viscosa

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stated in

Ineupatorolide-like sesquiterpene lactones from Dittrichia viscosa

Hymenoxys integrifolia

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stated in

Seco-helenanolides from Dugaldia integrifolia

Inula hupehensis

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stated in

Antimicrobial activities of some thymol derivatives from the roots of Inula hupehensis

Inula salsoloides

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stated in

Further sesquiterpene lactones from Inula salsoloides

Madia sativa

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stated in

New labdane derivatives from Madia sativa

Pulicaria arabica

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stated in

Caryophyllene derivatives from Pulicaria arabica

Pulicaria dysenterica

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stated in

Caryophyllene derivatives from Pulicaria dysenterica

Pulicaria scabra

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stated in

Caryophyllane derivatives from Pulicaria scabra

Picradeniopsis multiflora

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stated in

Neue diterpene aus Schkuhria-arten

Klasea latifolia

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stated in

Sesquiterpene lactones from Serratula latifolia

Telekia speciosa

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stated in

Further eudesmanolides and xanthanolides from Telekia speciosa

Pentanema divaricatum

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stated in

Sesquiterpene Lactones and Thymol Esters fromVicoa pentanema

Vicoa divaricata

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stated in

Sesquiterpene Lactones and Thymol Esters fromVicoa pentanema

Identifiers

InChI

InChI=1S/C18H24O5/c1-11(2)16(19)21-9-18(10-22-18)14-7-6-13(5)8-15(14)23-17(20)12(3)4/h6-8,11-12H,9-10H2,1-5H3/t18-/m0/s1

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InChIKey

OLARKEMZPWGFJU-SFHVURJKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OLARKEMZPWGFJU-SFHVURJKSA-N

1 reference

(Q105193873)

[(2R)-2-[4-methyl-2-(2-methylpropanoyloxy)phenyl]oxiran-2-yl]methyl 2-methylpropanoate

Statements

Identifiers

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