(Q105005763)

English

(3aS)-3-Methylene-4alpha-hydroxy-5beta-[(S)-1-methyl-4-acetoxybutyl]-6-(hydroxymethyl)-2,3,3aalpha,4,7,7aalpha-hexahydrobenzofuran-2-one

chemical compound

In more languages

Statements

type of chemical entity

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4-[4-Hydroxy-6-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-5-yl]pentyl acetate

1 reference

based on heuristic

inferred from SMILES

324.157288488 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₄O₆

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canonical SMILES

O=C1OC2CC(=C(C(O)C2C1=C)C(C)CCCOC(=O)C)CO

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isomeric SMILES

C=C1C(=O)O[C@@H]2CC(CO)=C([C@@H](C)CCCOC(C)=O)[C@@H](O)[C@H]12

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1 reference

New sesquiterpenes from Inula japonica Thunb. with their inhibitory activities against LPS-induced NO production in RAW264.7 macrophages

Inula britannica

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New sesquiterpenes from Inula japonica Thunb. with their inhibitory activities against LPS-induced NO production in RAW264.7 macrophages

Pentanema britannicum

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New sesquiterpenes from Inula japonica Thunb. with their inhibitory activities against LPS-induced NO production in RAW264.7 macrophages

Identifiers

InChI=1S/C17H24O6/c1-9(5-4-6-22-11(3)19)14-12(8-18)7-13-15(16(14)20)10(2)17(21)23-13/h9,13,15-16,18,20H,2,4-8H2,1,3H3/t9-,13+,15+,16+/m0/s1

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GBCQJTCNEGBWMD-CZLJMHDISA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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