(Q105345412)

English

[(3aS,6aS,8S,9aR,9bS)-6a-hydroxy-3,6,9-trimethylidene-2-oxo-4,5,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-8-yl] 3-methylbutanoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6a-hydroxy-3,6,9-trimethylidene-2-oxo-hexahydro-3aH-azuleno[4,5-b]furan-8-yl 3-methylbutanoate

1 reference

based on heuristic

inferred from SMILES

mass

346.178023932 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₅

0 references

canonical SMILES

O=C1OC2C(C1=C)CCC(=C)C3(O)CC(OC(=O)CC(C)C)C(=C)C23

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isomeric SMILES

C=C1C(=O)O[C@H]2[C@H]1CCC(=C)[C@]1(O)C[C@H](OC(=O)CC(C)C)C(=C)[C@H]21

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found in taxon

Rhodanthe moschata

1 reference

stated in

Sesquiterpene lactones and other constituents from Australian Helipterum species

Identifiers

InChI

InChI=1S/C20H26O5/c1-10(2)8-16(21)24-15-9-20(23)11(3)6-7-14-12(4)19(22)25-18(14)17(20)13(15)5/h10,14-15,17-18,23H,3-9H2,1-2H3/t14-,15-,17+,18-,20+/m0/s1

0 references

InChIKey

YAJHDHDODNNHPF-CHBAHTGHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YAJHDHDODNNHPF-CHBAHTGHSA-N

(Q105345412)

[(3aS,6aS,8S,9aR,9bS)-6a-hydroxy-3,6,9-trimethylidene-2-oxo-4,5,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-8-yl] 3-methylbutanoate

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Identifiers

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