Lathycarpin (CHEBI:186287)

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	Lathycarpin

ChEBI ID	CHEBI:186287

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

Submitter	MetaboLights

Supplier Information	eMolecules:1745254, ZINC000000529951

Download	Molfile XML SDF

Formula

C18H16O7

Net Charge

Average Mass

344.319

Monoisotopic Mass

344.08960

InChI

InChI=1S/C18H16O7/c1-20-13-3-9-11(5-14(13)21-2)22-7-18(19)10-4-15-16(24-8-23-15)6-12(10)25-17(9)18/h3-6,17,19H,7-8H2,1-2H3

InChIKey

OPUNZSMLSXSMJN-UHFFFAOYSA-N

SMILES

O1C2C(O)(C=3C1=CC=4OCOC4C3)COC=5C2=CC(OC)=C(OC)C5

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	Lathycarpin (CHEBI:186287) is a pterocarpans (CHEBI:26377)

IUPAC Name

15,16-dimethoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-1-ol