Sargabetaopenilline G (CHEBI:203559)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	Sargabetaopenilline G

ChEBI ID	CHEBI:203559

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H24O8

Net Charge

Average Mass

368.382

Monoisotopic Mass

368.14712

InChI

InChI=1S/C18H24O8/c1-9-5-6-15(24-10(2)19)18(26-9)16(25-11(3)20)12-7-14(21)17(4,22)13(12)8-23-18/h9,15-16,22H,5-8H2,1-4H3/t9-,15-,16+,17+,18-/m0/s1

InChIKey

YSZSEYNPMYSAEI-MHUIHPTQSA-N

SMILES

O=C1[C@](O)(C=2CO[C@]3([C@@H](C2C1)OC(=O)C)O[C@H](CC[C@@H]3OC(=O)C)C)C

Metabolite of Species	Details
Penicillium (NCBI:txid5073)	See: PubMed

ChEBI Ontology
Outgoing	Sargabetaopenilline G (CHEBI:203559) is a ketal (CHEBI:59777)

IUPAC Name

[(3S,3'S,4R,6'S,7R)-4-acetyloxy-7-hydroxy-6',7-dimethyl-6-oxospiro[4,5-dihydro-1H-cyclopenta[c]pyran-3,2'-oxane]-3'-yl] acetate