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8-O-methyl-fusarubinlactone

PropertiesImage
MNX_IDMNXM164399 Image of MNXM164399
referencemetacycM:CPD-18197
formulaC16H14O8
global charge0
mol weight334.28
InChIKeyAMGBYYVWJBYSHU-UHFFFAOYSA-N
InChIInChI=1S/C16H14O8/c1-16(21)5-6-9(15(20)24-16)14(19)10-7(22-2)4-8(23-3)13(18)11(10)12(6)17/h4,18,21H,5H2,1-3H3
SMILESCOC1=CC(OC)=C(O)C2=C1C(=O)C1=C(CC(C)(O)OC1=O)C2=O
MNX internals
InChI (mnx)InChI=1/C16H14O8/c1-16(21)5-6-9(15(20)24-16)14(19)10-7(22-2)4-8(23-3)13(18)11(10)12(6)17/h4,18,21H,5H2,1-3H3/t16? Image of MNXM164399
SMILES (mnx)[CH3:1][C:16]1([OH:21])[CH2:5][C:6]2=[C:9]([C:14](=[O:19])[C:10]3=[C:11]([C:12]2=[O:17])[C:13]([OH:18])=[C:8]([O:23][CH3:3])[CH:4]=[C:7]3[O:22][CH3:2])[C:15](=[O:20])[O:24]1
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

metacyc.compound:CPD-18197
metacycM:CPD-18197
seed.compound:cpd34995
seedM:cpd34995
AMGBYYVWJBYSHU-UHFFFAOYSA-N
8-O-methyl-fusarubinlactone

seedM:M_cpd34995
secondary/obsolete/fantasy identifier