Methylnissolin (CHEBI:174866)

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	Methylnissolin

ChEBI ID	CHEBI:174866

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H16O5

Net Charge

Average Mass

300.310

Monoisotopic Mass

300.09977

InChI

InChI=1S/C17H16O5/c1-19-13-6-5-10-12-8-21-14-7-9(18)3-4-11(14)15(12)22-16(10)17(13)20-2/h3-7,12,15,18H,8H2,1-2H3

InChIKey

UOVGCLXUTLXAEC-UHFFFAOYSA-N

SMILES

O1C2C(C3=C1C(OC)=C(OC)C=C3)COC4=C2C=CC(O)=C4

ChEBI Ontology
Outgoing	Methylnissolin (CHEBI:174866) is a pterocarpans (CHEBI:26377)

IUPAC Name

9,10-dimethoxy-6a,11a-dihydro-6H-[1]benzouro[3,2-c]chromen-3-ol