(Q104919448)

English

Xanthalongin

chemical compound

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Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

(7S,8aR)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

(7S,8aS)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

8-epi-Tomentosin

1 reference

based on heuristic

inferred from SMILES

248.1412445 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aS,7R,8aR)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aS,7S,8aS)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₀O₃

0 references

canonical SMILES

O=C1OC2CC(C(=CCC2C1=C)CCC(=O)C)C

0 references

isomeric SMILES

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

0 references

Arnica longifolia

1 reference

Structure revision of xanthalongin and further sesquiterpene lactones from flowers of Arnica longifolia

1 reference

Sesquiterpenes and other constituents from the aerial parts of Inula japonica

Dittrichia graveolens

1 reference

Ichthyotoxic sesquiterpenes and xanthanolides from Dittrichia graveolens

Rhanteriopsis bombycina

1 reference

A seco-guaianolide and other sesquiterpene lactones from Postia bombycina

Identifiers

InChI=1S/C15H20O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h6,9,13-14H,3-5,7-8H2,1-2H3/t9-,13-,14-/m1/s1

0 references

AVFIYMSJDDGDBQ-OWYVNGRQSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

AVFIYMSJDDGDBQ-OWYVNGRQSA-N

UniChem compound ID

1 reference

Sitelinks

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