(Q105351691)

English

[(3aR,4R,6aR,9aR,9bR)-9-methyl-3,6-dimethylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] furan-3-carboxylate

chemical compound

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instance of

type of chemical entity

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subclass of

9-methyl-3,6-dimethylidene-2-oxo-3aH,4H,5H,6aH,7H,9aH,9bH-azuleno[4,5-b]furan-4-yl furan-3-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

340.13107374 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₀O₅

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canonical SMILES

O=C(OC1CC(=C)C2CC=C(C)C2C3OC(=O)C(=C)C13)C4=COC=C4

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isomeric SMILES

C=C1C[C@@H](OC(=O)c2ccoc2)[C@H]2C(=C)C(=O)O[C@@H]2[C@H]2C(C)=CC[C@@H]12

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found in taxon

Helogyne apaloidea

1 reference

stated in

Helogynic acid, a homoditerpene, and other constituents from Helogyne apaloidea

Identifiers

InChI

InChI=1S/C20H20O5/c1-10-4-5-14-11(2)8-15(24-20(22)13-6-7-23-9-13)17-12(3)19(21)25-18(17)16(10)14/h4,6-7,9,14-18H,2-3,5,8H2,1H3/t14-,15+,16-,17+,18+/m0/s1

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InChIKey

YPIBIZJIVAIQHC-IGKNDFSCSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YPIBIZJIVAIQHC-IGKNDFSCSA-N

(Q105351691)

[(3aR,4R,6aR,9aR,9bR)-9-methyl-3,6-dimethylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] furan-3-carboxylate

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Identifiers

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