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Dihydrowyerol

PropertiesImage
MNX_IDMNXM124942 Image of MNXM124942
referencechebi:174464
formulaC15H18O4
global charge0
mol weight262.305
InChIKeyLQJHQXFOPADMRA-LUAWRHEFSA-N
InChIInChI=1S/C15H18O4/c1-3-4-5-6-7-13(16)14-10-8-12(19-14)9-11-15(17)18-2/h8-11,13,16H,3-5H2,1-2H3/b11-9-
SMILESCCCCC#CC(O)C1=CC=C(/C=C\C(=O)OC)O1
MNX internals
InChI (mnx)InChI=1/C15H18O4/c1-3-4-5-6-7-13(16)14-10-8-12(19-14)9-11-15(17)18-2/h8-11,13,16H,3-5H2,1-2H3/b11-9-/t13? Image of MNXM124942
SMILES (mnx)[CH3:1][CH2:3][CH2:4][CH2:5][C:6]#[C:7][CH:13]([C:14]1=[CH:10][CH:8]=[C:12](/[CH:9]=[CH:11]\[C:15](=[O:17])[O:18][CH3:2])[O:19]1)[OH:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:174464
chebi:174464
LQJHQXFOPADMRA-LUAWRHEFSA-N
Dihydrowyerol
methyl (Z)-3-[5-(1-hydroxyhept-2-ynyl)uran-2-yl]prop-2-enoate
hmdb:HMDB0039497
LQJHQXFOPADMRA-LUAWRHEFSA-N
Dihydrowyerol
Methyl (2Z)-3-[5-(1-hydroxyhept-2-yn-1-yl)furan-2-yl]prop-2-enoic acid
methyl (2Z)-3-[5-(1-hydroxyhept-2-yn-1-yl)furan-2-yl]prop-2-enoate

hmdb:HMDB39497
secondary/obsolete/fantasy identifier