(Q105176720)

English

[(3S,3aR,4aR,8aR,9aR)-4a-hydroperoxy-3-methyl-5-methylidene-2-oxo-3,3a,4,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-8a-yl]methyl acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

{4a-hydroperoxy-3-methyl-5-methylidene-2-oxo-octahydronaphtho[2,3-b]furan-8a-yl}methyl 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=C(OCC12CCCC(=C)C2(OO)CC3C(OC(=O)C3C)C1)C

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isomeric SMILES

C=C1CCC[C@]2(COC(C)=O)C[C@H]3OC(=O)[C@@H](C)[C@H]3C[C@@]12OO

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Eriocephalus africanus

2 references

Sesquiterpene lactones and other constituents from Eriocephalus species

Sesquiterpene lactones and other constituents from Eriocephalus species

Identifiers

InChI=1S/C17H24O6/c1-10-5-4-6-16(9-21-12(3)18)8-14-13(7-17(10,16)23-20)11(2)15(19)22-14/h11,13-14,20H,1,4-9H2,2-3H3/t11-,13+,14+,16+,17+/m0/s1

0 references

NBDSLJJVKIEFJQ-RFOKVQRGSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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