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glucodigifucoside

MNXM11688 is deprecated and here replaced by MNXM727149
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM727149Image of MNXM727149
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC35H54O13
charge0
mass682.35644
referencemetacycM:CPD-10539
InChIKeyOQZGLOBKVNEEPK-HWFOAHAPSA-N
InChIInChI=1S/C35H54O13/c1-16-30(48-32-28(41)26(39)25(38)23(14-36)47-32)27(40)29(42)31(45-16)46-19-6-9-33(2)18(13-19)4-5-22-21(33)7-10-34(3)20(8-11-35(22,34)43)17-12-24(37)44-15-17/h12,16,18-23,25-32,36,38-43H,4-11,13-15H2,1-3H3/t16-,18-,19+,20-,21+,22-,23-,25-,26+,27-,28-,29-,30+,31-,32+,33+,34-,35+/m1/s1
SMILESC[C@H]1O[C@H](O[C@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@@H]3C2)[C@H](O)[C@@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-10539
metacycM:CPD-10539
seed.compound:cpd22708
seedM:cpd22708 		glucodigifucoside
seedM:M_cpd22708 secondary/obsolete/fantasy identifier