Nebularilactone B (CHEBI:213735)

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	Nebularilactone B

ChEBI ID	CHEBI:213735

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H22O3

Net Charge

Average Mass

250.338

Monoisotopic Mass

250.15689

InChI

InChI=1S/C15H22O3/c1-14(2)7-6-12(16)15(3)10-8-18-13(17)9(10)4-5-11(14)15/h4,10-12,16H,5-8H2,1-3H3/t10-,11-,12-,15+/m0/s1

InChIKey

CARRQZUFRIOSMY-JUFZMCDQSA-N

SMILES

O=C1OC[C@H]2C1=CC[C@H]3C(CC[C@@H]([C@]23C)O)(C)C

Metabolite of Species	Details
Clitocybe nebularis (NCBI:txid117024)	See: DOI

ChEBI Ontology
Outgoing	Nebularilactone B (CHEBI:213735) is a naphthofuran (CHEBI:39270)

IUPAC Name

(5aS,9S,9aS,9bR)-9-hydroxy-6,6,9a-trimethyl-5,5a,7,8,9,9b-hexahydro-1H-benzo[e][2]benzouran-3-one