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prosolanapyrone II

PropertiesImage
MNX_IDMNXM5284 Image of MNXM5284
referencechebi:38238
formulaC18H24O4
global charge0
mol weight304.386
InChIKeyFAKIZFXTXMMNRM-JHHIBIJLSA-N
InChIInChI=1S/C18H24O4/c1-3-4-5-6-7-8-9-10-11-12-15-13-17(21-2)16(14-19)18(20)22-15/h3-6,11-13,19H,7-10,14H2,1-2H3/b4-3+,6-5+,12-11+
SMILESC/C=C/C=C/CCCC/C=C/c1cc(OC)c(CO)c(=O)o1
MNX internals
InChI (mnx)InChI=1/C18H24O4/c1-3-4-5-6-7-8-9-10-11-12-15-13-17(21-2)16(14-19)18(20)22-15/h3-6,11-13,19H,7-10,14H2,1-2H3/b4-3+,6-5+,12-11+ Image of MNXM5284
SMILES (mnx)[CH:1]1=[C:9](/[CH:10]=[CH:11]/[CH2:12][CH2:13][CH2:14][CH2:15]/[CH:16]=[CH:17]\[CH:18]=[O:19]\[OH:20])[CH2:2][C:3](=[CH2:4])[C:6]([O:21][OH:22])=[C:5]1[CH2:7][CH3:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:38238
chebi:38238
FAKIZFXTXMMNRM-JHHIBIJLSA-N 		prosolanapyrone II
3-(hydroxymethyl)-4-methoxy-6-[(1E,7E,9E)-undeca-1,7,9-trien-1-yl]-2H-pyran-2-one

sabiork.compound:31252
sabiorkM:31252
kegg.compound:C19933
keggC:C19933
FAKIZFXTXMMNRM-JHHIBIJLSA-N 		Prosolanapyrone II

seed.compound:cpd21172
seedM:cpd21172
FAKIZFXTXMMNRM-JHHIBIJLSA-N 		Prosolanapyrone II
prosolanapyrone II

metacyc.compound:CPD-13654
metacycM:CPD-13654
FAKIZFXTXMMNRM-JHHIBIJLSA-N 		prosolanapyrone II

keggC:M_C19933
seedM:M_cpd21172 		secondary/obsolete/fantasy identifier