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8-O-methylnectriafurone

PropertiesImage
MNX_IDMNXM166709 Image of MNXM166709
referencemetacycM:CPD-18188
formulaC16H14O7
global charge0
mol weight318.281
InChIKeyMZKMQTBWJGHUTB-UHFFFAOYSA-N
InChIInChI=1S/C16H14O7/c1-6(17)16-10-7(5-23-16)13(18)11-8(21-2)4-9(22-3)14(19)12(11)15(10)20/h4-6,17,19H,1-3H3
SMILESCOC1=CC(OC)=C(O)C2=C1C(=O)C1=COC(C(C)O)=C1C2=O
MNX internals
InChI (mnx)InChI=1/C16H14O7/c1-6(17)16-10-7(5-23-16)13(18)11-8(21-2)4-9(22-3)14(19)12(11)15(10)20/h4-6,17,19H,1-3H3/t6? Image of MNXM166709
SMILES (mnx)[CH3:1][CH:6]([C:16]1=[C:10]2[C:7](=[CH:5][O:23]1)[C:13](=[O:18])[C:11]1=[C:12]([C:14]([OH:19])=[C:9]([O:22][CH3:3])[CH:4]=[C:8]1[O:21][CH3:2])[C:15]2=[O:20])[OH:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-18188
metacycM:CPD-18188
seed.compound:cpd33189
seedM:cpd33189
MZKMQTBWJGHUTB-UHFFFAOYSA-N
8-O-methylnectriafurone

seedM:M_cpd33189
secondary/obsolete/fantasy identifier