(Q104996486)

English

(3aS,5aR,6S,9aS,9bS)-6-hydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6-Hydroxy-5a-methyl-3,9-dimethylidenedecahydronaphtho[1,2-b]furan-2(3h)-one

1 reference

based on heuristic

inferred from SMILES

mass

248.1412445 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from InChI

(3aS,5aS,6S,9aR,9bR)-6-hydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from InChI

(3aR,5aS,6R,9aS,9bR)-6-hydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₀O₃

0 references

canonical SMILES

O=C1OC2C(C1=C)CCC3(C)C(O)CCC(=C)C23

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isomeric SMILES

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

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found in taxon

Schistostephium rotundifolium

1 reference

stated in

Sesquiterpene lactones and other constituents from Schistostephium species

Identifiers

InChI

InChI=1S/C15H20O3/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h10-13,16H,1-2,4-7H2,3H3/t10-,11-,12+,13-,15-/m0/s1

0 references

InChIKey

FKBUODICGDOIGB-AIUMHDJVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FKBUODICGDOIGB-AIUMHDJVSA-N

(Q104996486)

(3aS,5aR,6S,9aS,9bS)-6-hydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

Statements

Identifiers

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