(Q105193066)

English

[(E)-2-[(3aR,4R,6R,6aS,7R,9aR,9bR)-7-hydroxy-9-methyl-3-methylidene-2-oxospiro[4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-6,2'-oxirane]-4-yl]oxycarbonylbut-2-enyl] (E)-2-(hydroxymethyl)but-2-enoate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

2-(7-hydroxy-9-methyl-3-methylidene-2-oxospiro[4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-6,2'-oxirane]-4-yl)oxycarbonylbut-2-enyl 2-(hydroxymethyl)but-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

474.18898254 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₀O₉

0 references

canonical SMILES

O=C(OCC(=CC)C(=O)OC1CC2(OC2)C3C(O)C=C(C)C3C4OC(=O)C(=C)C14)C(=CC)CO

0 references

isomeric SMILES

C=C1C(=O)O[C@@H]2[C@H]3C(C)=C[C@@H](O)[C@H]3[C@@]3(CO3)C[C@@H](OC(=O)/C(=C/C)COC(=O)/C(=C/C)CO)[C@@H]12

0 references

found in taxon

Liatris squarrosa

1 reference

stated in

Guaianolides from Liatris squarrosa

Identifiers

InChI

InChI=1S/C25H30O9/c1-5-14(9-26)23(29)31-10-15(6-2)24(30)33-17-8-25(11-32-25)20-16(27)7-12(3)18(20)21-19(17)13(4)22(28)34-21/h5-7,16-21,26-27H,4,8-11H2,1-3H3/b14-5+,15-6+/t16-,17-,18+,19-,20-,21-,25+/m1/s1

0 references

InChIKey

OJGCMHDRPRMYPP-XUURKMTHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OJGCMHDRPRMYPP-XUURKMTHSA-N

(Q105193066)

[(E)-2-[(3aR,4R,6R,6aS,7R,9aR,9bR)-7-hydroxy-9-methyl-3-methylidene-2-oxospiro[4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-6,2'-oxirane]-4-yl]oxycarbonylbut-2-enyl] (E)-2-(hydroxymethyl)but-2-enoate

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)