Mangostinone (CHEBI:175012)

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	Mangostinone

ChEBI ID	CHEBI:175012

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C23H24O5

Net Charge

Average Mass

380.440

Monoisotopic Mass

380.16237

InChI

InChI=1S/C23H24O5/c1-13(2)6-4-7-14(3)10-11-15-18(25)12-19-20(21(15)26)22(27)16-8-5-9-17(24)23(16)28-19/h5-6,8-10,12,24-26H,4,7,11H2,1-3H3/b14-10+

InChIKey

RJLWIAOXQDZMTB-GXDHUFHOSA-N

SMILES

O1C2=C(C(O)=C(C\C=C(\CCC=C(C)C)/C)C(O)=C2)C(=O)C3=C1C(O)=CC=C3

ChEBI Ontology
Outgoing	Mangostinone (CHEBI:175012) is a xanthones (CHEBI:51149)

IUPAC Name

2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5-trihydroxyxanthen-9-one