(Q105193350)

English

[(1S,5R,6R)-5-[[(1R,3aR,7R,7aS)-7-hydroxy-3a,7-dimethyl-3-oxo-4,5,6,7a-tetrahydro-1H-2-benzofuran-1-yl]methyl]-7-methylidene-4-oxo-6-bicyclo[3.2.1]oct-2-enyl] acetate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

[5-[(7-hydroxy-3a,7-dimethyl-3-oxo-4,5,6,7a-tetrahydro-1H-2-benzofuran-1-yl)methyl]-7-methylidene-4-oxo-6-bicyclo[3.2.1]oct-2-enyl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

388.188588616 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₈O₆

0 references

canonical SMILES

O=C(OC1C(=C)C2C=CC(=O)C1(C2)CC3OC(=O)C4(C)CCCC(O)(C)C34)C

0 references

isomeric SMILES

C=C1[C@@H]2C=CC(=O)[C@@](C[C@H]3OC(=O)[C@]4(C)CCC[C@@](C)(O)[C@H]34)(C2)[C@@H]1OC(C)=O

0 references

found in taxon

Wedelia regis

1 reference

stated in

Diterpene lactones and other constituents from Wedelia and Aspilia species

Identifiers

InChI

InChI=1S/C22H28O6/c1-12-14-6-7-16(24)22(10-14,18(12)27-13(2)23)11-15-17-20(3,19(25)28-15)8-5-9-21(17,4)26/h6-7,14-15,17-18,26H,1,5,8-11H2,2-4H3/t14-,15-,17-,18-,20-,21-,22+/m1/s1

0 references

InChIKey

OJXJQFQBGRICDT-WQYUKGOZSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OJXJQFQBGRICDT-WQYUKGOZSA-N

(Q105193350)

[(1S,5R,6R)-5-[[(1R,3aR,7R,7aS)-7-hydroxy-3a,7-dimethyl-3-oxo-4,5,6,7a-tetrahydro-1H-2-benzofuran-1-yl]methyl]-7-methylidene-4-oxo-6-bicyclo[3.2.1]oct-2-enyl] acetate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)