Picrotin, analytical standard (CHEBI:181758)

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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	Picrotin, analytical standard

ChEBI ID	CHEBI:181758

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

Submitter	MetaboLights

Supplier Information

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Formula

C15H18O7

Net Charge

Average Mass

310.302

Monoisotopic Mass

310.10525

InChI

InChI=1S/C15H18O7/c1-12(2,18)6-7-10(16)20-8(6)9-13(3)14(7,19)4-5-15(13,22-5)11(17)21-9/h5-9,18-19H,4H2,1-3H3

InChIKey

RYEFFICCPKWYML-UHFFFAOYSA-N

SMILES

O1C23C4(C(O)(CC12)C5C(C(OC5=O)C4OC3=O)C(O)(C)C)C

ChEBI Ontology
Outgoing	Picrotin, analytical standard (CHEBI:181758) is a furopyran (CHEBI:74927)

IUPAC Name

1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione