Penisporolide A (CHEBI:198728)

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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	Penisporolide A

ChEBI ID	CHEBI:198728

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H30O5

Net Charge

Average Mass

326.433

Monoisotopic Mass

326.20932

InChI

InChI=1S/C18H30O5/c1-4-12(19)7-5-6-8-13-9-10-18(22-13)11-14-15(23-18)17(2,3)16(20)21-14/h12-15,19H,4-11H2,1-3H3/t12-,13+,14-,15+,18+/m0/s1

InChIKey

BJYDMDQYCGNRKX-CGSPGFDNSA-N

SMILES

O=C1O[C@H]2C[C@]3(O[C@H](CCCC[C@@H](O)CC)CC3)O[C@H]2C1(C)C

Metabolite of Species	Details
Penicilliumspecies (NCBI:txid5081)	See: PubMed

ChEBI Ontology
Outgoing	Penisporolide A (CHEBI:198728) is a aliphatic alcohol (CHEBI:2571)

IUPAC Name

(3aS,5R,5'R,6aS)-5'-[(5S)-5-hydroxyheptyl]-3,3-dimethylspiro[6,6a-dihydro-3aH-uro[3,2-b]uran-5,2'-oxolane]-2-one