Mniopetal F (CHEBI:227649)

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	Mniopetal F

ChEBI ID	CHEBI:227649

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H20O5

Net Charge

Average Mass

280.320

Monoisotopic Mass

280.13107

InChI

InChI=1S/C15H20O5/c1-14(2)6-5-10(17)15-9(14)4-3-8(7-16)11(15)12(18)20-13(15)19/h3,7,9-12,17-18H,4-6H2,1-2H3/t9-,10-,11+,12-,15-/m0/s1

InChIKey

DOHIWMLRTRMJIJ-HJHSNUOESA-N

SMILES

O=C1O[C@H](O)[C@@H]2[C@]13[C@@H](O)CCC([C@@H]3CC=C2C=O)(C)C

ChEBI Ontology
Outgoing	Mniopetal F (CHEBI:227649) is a naphthofuran (CHEBI:39270)

IUPAC Name

(3S,3aS,6aS,10S,10aR)-3,10-dihydroxy-7,7-dimethyl-1-oxo-3a,6,6a,8,9,10-hexahydro-3H-benzo[d][2]benzouran-4-carbaldehyde