Thielavialide D (CHEBI:199975)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Thielavialide D

ChEBI ID	CHEBI:199975

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

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Formula

C14H18O5

Net Charge

Average Mass

266.293

Monoisotopic Mass

266.11542

InChI

InChI=1S/C14H18O5/c1-8-4-3-5-14(19-8)6-9-10(7-18-14)12(16)13(2,17)11(9)15/h8,17H,3-7H2,1-2H3/t8-,13+,14-/m0/s1

InChIKey

BUUQIDZEVQVFNH-PCTYZZJISA-N

SMILES

O=C1C2=C(C[C@]3(O[C@H](CCC3)C)OC2)C([C@]1(O)C)=O

Metabolite of Species	Details
Thielaviaspecies PA0001 (NCBI:txid1511729)	See: PubMed

ChEBI Ontology
Outgoing	Thielavialide D (CHEBI:199975) is a ketal (CHEBI:59777)

IUPAC Name

(3S,6R,6'S)-6-hydroxy-6,6'-dimethylspiro[1,4-dihydrocyclopenta[c]pyran-3,2'-oxane]-5,7-dione