(Q105169217)

English

[(2Z,5R,8S)-2-penta-2,4-diynylidene-1,10-dioxaspiro[4.5]dec-3-en-8-yl] 3-methylbutanoate

chemical compound

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instance of

type of chemical entity

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subclass of

(2-Penta-2,4-diynylidene-1,10-dioxaspiro[4.5]dec-3-en-8-yl) 3-methylbutanoate

1 reference

based on heuristic

inferred from SMILES

mass

300.13615912 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₀O₄

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canonical SMILES

O=C(OC1COC2(OC(=CC#CC#C)C=C2)CC1)CC(C)C

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isomeric SMILES

C#CC#C/C=C1/C=C[C@@]2(CC[C@H](OC(=O)CC(C)C)CO2)O1

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found in taxon

Tanacetum heterotomum

1 reference

stated in

A sesquiterpene-coumarin ether and an acetylenic compound from Tanacetum heterotomum

Identifiers

InChI

InChI=1S/C18H20O4/c1-4-5-6-7-15-8-10-18(22-15)11-9-16(13-20-18)21-17(19)12-14(2)3/h1,7-8,10,14,16H,9,11-13H2,2-3H3/b15-7-/t16-,18-/m0/s1

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InChIKey

MOWZFHQUHAVMGW-SRVMLKLISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MOWZFHQUHAVMGW-SRVMLKLISA-N

(Q105169217)

[(2Z,5R,8S)-2-penta-2,4-diynylidene-1,10-dioxaspiro[4.5]dec-3-en-8-yl] 3-methylbutanoate

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