filiforminol (CHEBI:134193)

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ChEBI Name	filiforminol

ChEBI ID	CHEBI:134193

Definition	A tricyclic sesquiterpenoid that is isolated from the Australian marine alga Laurencia filiformis.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C15H19BrO2

Net Charge

Average Mass

311.214

Monoisotopic Mass

310.05684

InChI

InChI=1S/C15H19BrO2/c1-9-6-13-11(7-12(9)16)14(3)4-5-15(8-17,18-13)10(14)2/h6-7,10,17H,4-5,8H2,1-3H3/t10-,14+,15+/m0/s1

InChIKey

HEDUCRHYGUKWLO-COLVAYQJSA-N

SMILES

CC1=CC2=C(C=C1Br)[C@]3(C)CC[C@@](CO)([C@H]3C)O2

Metabolite of Species	Details
Laurencia filiformis (NCBI:txid110462)	See: PubMed
Apis cerana (NCBI:txid7461)	See: MetaboLights Study

Roles Classification
Biological Role(s):	marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms. algal metabolite Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae.

ChEBI Ontology
Outgoing	filiforminol (CHEBI:134193) has role algal metabolite (CHEBI:84735) filiforminol (CHEBI:134193) has role marine metabolite (CHEBI:76507) filiforminol (CHEBI:134193) is a cyclic ether (CHEBI:37407) filiforminol (CHEBI:134193) is a organic heterotricyclic compound (CHEBI:26979) filiforminol (CHEBI:134193) is a organobromine compound (CHEBI:37141) filiforminol (CHEBI:134193) is a primary alcohol (CHEBI:15734) filiforminol (CHEBI:134193) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name

[(2S,5R,10S)-7-bromo-5,8,10-trimethyl-4,5-dihydro-2,5-methano-1-benzoxepin-2(3H)-yl]methanol

Registry Number	Type	Source
62311-76-6	CAS Registry Number	KNApSAcK

Citation	Type	Source
19370917	PubMed citation	Europe PMC

Last Modified

14 June 2017