Epohelmin B (CHEBI:199087)

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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	Epohelmin B

ChEBI ID	CHEBI:199087

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H31NO2

Net Charge

Average Mass

293.451

Monoisotopic Mass

293.23548

InChI

InChI=1S/C18H31NO2/c1-2-3-4-5-6-10-16(20)11-7-9-15-14-18-17(21-18)12-8-13-19-15/h6,10,15,17-19H,2-5,7-9,11-14H2,1H3/b10-6+/t15-,17-,18+/m1/s1

InChIKey

CFZBYEMAQOZSHS-NENQMGKTSA-N

SMILES

O=C(/C=C/CCCCC)CCC[C@H]1NCCC[C@@H]2[C@H](C1)O2

ChEBI Ontology
Outgoing	Epohelmin B (CHEBI:199087) is a enone (CHEBI:51689)

IUPAC Name

(E)-1-[(1S,3R,8R)-9-oxa-4-azabicyclo[6.1.0]nonan-3-yl]undec-5-en-4-one