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neocarratetraose 4-O-disulfate

PropertiesImageOccurences in reactions
MNX_IDMNXM12443Image of MNXM12443
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC24H36O25S2
charge-2
mass788.09981
referenceseedM:cpd23881
InChIKeyPPWBJIYNGRTPNY-OKPLKWSVSA-L
InChIInChI=1S/C24H38O25S2/c25-1-5-15(48-50(33,34)35)19(10(28)21(32)41-5)46-23-12(30)18-14(8(44-23)4-40-18)45-24-13(31)20(16(6(2-26)42-24)49-51(36,37)38)47-22-11(29)17-9(27)7(43-22)3-39-17/h5-32H,1-4H2,(H,33,34,35)(H,36,37,38)/p-2/t5-,6-,7-,8-,9+,10-,11-,12-,13-,14+,15+,16+,17+,18-,19-,20-,21-,22-,23-,24+/m1/s1
SMILESO=S(=O)([O-])O[C@H]1[C@@H](CO)O[C@@H](O[C@H]2[C@H]3CO[C@@H]2[C@@H](O)[C@@H](O[C@H]2[C@@H](OS(=O)(=O)[O-])[C@@H](CO)O[C@@H](O)[C@@H]2O)O3)[C@H](O)[C@H]1O[C@H]1O[C@@H]2CO[C@@H]([C@H]2O)[C@H]1O
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Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-13446
metacycM:CPD-13446
seed.compound:cpd23881
seedM:cpd23881
neocarratetraose 4-O-disulfate
seedM:M_cpd23881 secondary/obsolete/fantasy identifier