(Q105209273)

English

(1R,3S,4S,4'S,5Z,5'S,8R)-2'-chloro-3,4',5'-trihydroxy-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylspiro[bicyclo[2.2.2]octane-8,6'-cyclohex-2-ene]-1',2,6-trione

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

2'-Chloro-3,4',5'-trihydroxy-5-(1-hydroxyhexa-2,4-dienylidene)-1,3-dimethylspiro[bicyclo[2.2.2]octane-8,6'-cyclohex-2-ene]-1',2,6-trione

1 reference

based on heuristic

inferred from SMILES

mass

422.113230756 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,3S,4S,4'S,5'S,8R)-2'-chloro-3,4',5'-trihydroxy-5-(1-hydroxyhexa-2,4-dienylidene)-1,3-dimethylspiro[bicyclo[2.2.2]octane-8,6'-cyclohex-2-ene]-1',2,6-trione

1 reference

based on heuristic

inferred from InChIKey

(1R,3S,4S,4'S,5'R,8R)-2'-chloro-3,4',5'-trihydroxy-5-(1-hydroxyhexa-2,4-dienylidene)-1,3-dimethylspiro[bicyclo[2.2.2]octane-8,6'-cyclohex-2-ene]-1',2,6-trione

1 reference

based on heuristic

inferred from InChI

(1R,3S,4S,4'S,5Z,5'R,8R)-2'-chloro-3,4',5'-trihydroxy-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylspiro[bicyclo[2.2.2]octane-8,6'-cyclohex-2-ene]-1',2,6-trione

1 reference

1 reference

C₂₁H₂₃ClO₇

0 references

canonical SMILES

O=C1C(Cl)=CC(O)C(O)C12CC3(C(=O)C(=C(O)C=CC=CC)C2C(O)(C3=O)C)C

0 references

isomeric SMILES

C/C=C/C=C/C(O)=C1/C(=O)[C@@]2(C)C[C@@]3(C(=O)C(Cl)=C[C@H](O)[C@H]3O)[C@@H]1[C@](C)(O)C2=O

0 references

found in taxon

Penicillium solitum

1 reference

stated in

Chloctanspirones A and B, novel chlorinated polyketides with an unprecedented skeleton, from marine sediment derived fungus Penicillium terrestre

Penicillium terrestre

1 reference

stated in

Chloctanspirones A and B, novel chlorinated polyketides with an unprecedented skeleton, from marine sediment derived fungus Penicillium terrestre

Identifiers

InChI

InChI=1S/C21H23ClO7/c1-4-5-6-7-11(23)13-14-20(3,29)18(28)19(2,17(13)27)9-21(14)15(25)10(22)8-12(24)16(21)26/h4-8,12,14,16,23-24,26,29H,9H2,1-3H3/b5-4+,7-6+,13-11-/t12-,14-,16+,19+,20-,21-/m0/s1

0 references

InChIKey

PHXAMGFMNFACCT-QAGFVOIRSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

PHXAMGFMNFACCT-QAGFVOIRSA-N

1 reference

(Q105209273)

(1R,3S,4S,4'S,5Z,5'S,8R)-2'-chloro-3,4',5'-trihydroxy-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylspiro[bicyclo[2.2.2]octane-8,6'-cyclohex-2-ene]-1',2,6-trione

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)