Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

diinsininol

PropertiesImageOccurences in reactions
MNX_IDMNXM104577Image of MNXM104577
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC36H32O16
charge0
mass720.16903
referencechebi:65792
InChIKeyDQBZPEAEXINSNR-QUCAXYRHSA-N
InChIInChI=1S/C36H32O16/c37-12-27-31(45)32(46)33(47)35(50-27)48-15-7-21(42)28-16-11-36(51-25(28)8-15,14-2-4-18(39)20(41)6-14)52-26-10-23(44)30-22(43)9-24(49-34(30)29(16)26)13-1-3-17(38)19(40)5-13/h1-8,10,16,24,27,31-33,35,37-42,44-47H,9,11-12H2/t16-,24-,27-,31-,32+,33-,35-,36-/m1/s1
SMILESO=C1C[C@H](c2ccc(O)c(O)c2)Oc2c1c(O)cc1c2[C@@H]2C[C@@](c3ccc(O)c(O)c3)(Oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c32)O1
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:65792
chebi:65792 		diinsininol
(2R,8R,14R)-2,8-bis(3,4-dihydroxyphenyl)-5,13-dihydroxy-4-oxo-3,4-dihydro-2H,14H-8,14-methanochromeno[7,8-d][1,3]benzodioxocin-11-yl beta-D-glucopyranoside
5,7,3',4'-tetrahydroxyflavanyl-7-O-beta-glucosyl-(4beta-8;2beta-O-7)-eriodictyol