Mabetaarigenin D (CHEBI:209671)

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	Mabetaarigenin D

ChEBI ID	CHEBI:209671

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H12O5

Net Charge

Average Mass

224.212

Monoisotopic Mass

224.06847

InChI

InChI=1S/C11H12O5/c1-5-3-4-7(12)9(14)11(5)8(13)6(2)16-10(11)15/h3-5,8-9,13-14H,2H2,1H3/t5-,8+,9-,11-/m0/s1

InChIKey

MWZYYACVPIJBPD-YQRDOJIBSA-N

SMILES

O=C1C=C[C@H](C)[C@]2([C@H]1O)C(=O)OC([C@H]2O)=C

Metabolite of Species	Details
Massarina (NCBI:txid45292)	See: PubMed

ChEBI Ontology
Outgoing	Mabetaarigenin D (CHEBI:209671) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(4S,5S,6R,10S)-4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione