(Q105180040)

English

(3aS,9aR,9bS)-9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione

1 reference

based on heuristic

inferred from SMILES

mass

260.104858992 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3aR,9aS,9bR)-9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,9aS,9bS)-9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione

2 references

based on heuristic

inferred from InChIKey

1 reference

C₁₅H₁₆O₄

0 references

canonical SMILES

O=C1OC2C3C(C(=O)C=C3CO)=C(C)CCC2C1=C

0 references

isomeric SMILES

C=C1C(=O)O[C@H]2[C@H]1CCC(C)=C1C(=O)C=C(CO)[C@H]12

0 references

found in taxon

Helminthotheca echioides

1 reference

stated in

Sesquiterpene lactones from Picris echioides

Identifiers

InChI

InChI=1S/C15H16O4/c1-7-3-4-10-8(2)15(18)19-14(10)13-9(6-16)5-11(17)12(7)13/h5,10,13-14,16H,2-4,6H2,1H3/t10-,13+,14-/m0/s1

0 references

InChIKey

NIYXMGSLECQTQT-GDLCADMTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NIYXMGSLECQTQT-GDLCADMTSA-N

(Q105180040)

(3aS,9aR,9bS)-9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione

Statements

Identifiers

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