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colanic acid (E. coli K12) repeat unit

PropertiesImageOccurences in reactions
MNX_IDMNXM1112447Image of MNXM1112447
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC43H64O34
charge-2
mass1124.329
referencemetacycM:CPD-21522
InChIKeyOUPARBBCHBHSIL-OBXBUJCHSA-L
InChIInChI=1S/C43H66O34/c1-9-16(48)28(24(56)39(64-9)71-26-10(2)65-40(25(57)32(26)66-11(3)46)72-29-17(49)13(6-44)68-36(60)23(29)55)73-41-34(67-12(4)47)30(18(50)14(7-45)69-41)74-38-22(54)20(52)31(33(76-38)35(58)59)75-37-21(53)19(51)27-15(70-37)8-63-43(5,77-27)42(61)62/h9-10,13-34,36-41,44-45,48-57,60H,6-8H2,1-5H3,(H,58,59)(H,61,62)/p-2/t9-,10-,13+,14+,15+,16+,17+,18-,19+,20+,21+,22+,23+,24-,25-,26+,27-,28+,29-,30-,31-,32-,33-,34+,36+,37+,38+,39-,40-,41+,43+/m0/s1
SMILESCC(=O)O[C@H]1[C@H](O)[C@H](O[C@@H]2[C@@H](O)[C@H](O)O[C@H](CO)[C@H]2O)O[C@@H](C)[C@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](C(=O)[O-])[C@@H](O[C@H]4O[C@@H]5CO[C@@](C)(C(=O)[O-])O[C@@H]5[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H]2OC(C)=O)[C@@H]1O
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Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-21522
metacycM:CPD-21522
colanic acid (E. coli K12) repeat unit
4,6-pyruvoyl-alpha-D-galactosyl-(1->4)-beta-D-glucoronosyl-(1->3)-2-O-acetyl-alpha-D-galactosyl-(1->4)-alpha-L-fucosyl-(1->4)-3-O-acetyl-alpha-L-fucosyl-(1->3)-beta-D-glucose