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prosolanapyrone III

Properties

Image

Occurences in reactions

MNX_ID

MNXM3086

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₁₈H₂₂O₄

charge

mass

302.37

reference

chebi:63164

InChIKey

KINNIEOBQSTCFI-JHHIBIJLSA-N

InChI

InChI=1S/C18H22O4/c1-3-4-5-6-7-8-9-10-11-12-15-13-17(21-2)16(14-19)18(20)22-15/h3-6,11-14H,7-10H2,1-2H3/b4-3+,6-5+,12-11+

SMILES

[CH3:1]/[CH:3]=[CH:4]/[CH:5]=[CH:6]/[CH2:7][CH2:8][CH2:9][CH2:10]/[CH:11]=[CH:12]/[c:15]1[cH:13][c:17]([O:21][CH3:2])[c:16]([CH:14]=[O:19])[c:18](=[O:20])[o:22]1

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Similar chemical compounds in external resources
Identifier	Description
CHEBI:63164 chebi:63164	prosolanapyrone III 4-methoxy-2-oxo-6-[(1E,7E,9E)-undeca-1,7,9-trien-1-yl]-2H-pyran-3-carbaldehyde
kegg.compound:C19934 keggC:C19934	Prosolanapyrone III 4-Methoxy-2-oxo-6-(1E,7E,9E)-undeca-1,7,9-trien-1-yl-2H-pyran-3-carboxaldehyde
seed.compound:cpd21173 seedM:cpd21173	Prosolanapyrone III 4-Methoxy-2-oxo-6-(1E,7E,9E)-undeca-1,7,9-trien-1-yl-2H-pyran-3-carboxaldehyde 4-methoxy-2-oxo-6-(1E,7E,9E)-1,7,9-undecatrienyl-2H-pyran-3-carboxaldehyde prosolanapyrone III
metacyc.compound:CPD-13656 metacycM:CPD-13656	prosolanapyrone III 4-methoxy-2-oxo-6-(1E,7E,9E)-1,7,9-undecatrienyl-2H-pyran-3-carboxaldehyde
keggC:M_C19934 seedM:M_cpd21173	secondary/obsolete/fantasy identifier