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Capsicoside C3

PropertiesImageOccurences in reactions
MNX_IDMNXM120173Image of MNXM120173
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC44H70O17
charge0
mass870.4613
referencehmdb:HMDB0040950
InChIKeyOKFUWWZDPLSBLG-UHFFFAOYSA-N
InChIInChI=1S/C44H70O17/c1-19-7-12-44(55-17-19)20(2)30-27(61-44)14-25-23-6-5-21-13-22(8-10-42(21,3)24(23)9-11-43(25,30)4)56-40-35(52)33(50)37(29(16-46)58-40)59-41-36(53)38(32(49)28(15-45)57-41)60-39-34(51)31(48)26(47)18-54-39/h5,19-20,22-41,45-53H,6-18H2,1-4H3
SMILESCC1CCC2(OC1)OC1CC3C4CC=C5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(OC8OCC(O)C(O)C8O)C7O)C(O)C6O)CCC5(C)C4CCC3(C)C1C2C
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0040950 Capsicoside C3
2-[(2-{[4,5-dihydroxy-2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-eneoxy}oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy]oxane-3,4,5-triol
hmdb:HMDB40950 secondary/obsolete/fantasy identifier