(Q105211990)

English

(3S,3aS,6S,6aR,9aR,9bS)-6-hydroxy-9-(hydroxymethyl)-3,6-dimethyl-3a,4,5,6a,9a,9b-hexahydro-3H-azuleno[4,5-b]furan-2,7-dione

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

6-hydroxy-9-(hydroxymethyl)-3,6-dimethyl-3a,4,5,6a,9a,9b-hexahydro-3H-azuleno[4,5-b]furan-2,7-dione

1 reference

based on heuristic

inferred from SMILES

280.13107374 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₀O₅

0 references

canonical SMILES

O=C1OC2C3C(=CC(=O)C3C(O)(C)CCC2C1C)CO

0 references

isomeric SMILES

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

0 references

Picris hieracioides

2 references

Sesquiterpene Lactones from Flowers ofPicris hieracioidesL

Sesquiterpene Lactones from Flowers ofPicris hieracioidesL

Helminthotheca echioides

1 reference

Sesquiterpene lactones from Picris echioides

Identifiers

InChI=1S/C15H20O5/c1-7-9-3-4-15(2,19)12-10(17)5-8(6-16)11(12)13(9)20-14(7)18/h5,7,9,11-13,16,19H,3-4,6H2,1-2H3/t7-,9-,11-,12+,13-,15-/m0/s1

0 references

PNJPRRXAWYTOOM-ZAXADQHBSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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