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Petunidin 3-gentiobioside

PropertiesImageOccurences in reactions
MNX_IDMNXM28615Image of MNXM28615
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC28H33O17
charge1
mass641.17123
referencelipidmapsM:LMPK12010351
InChIKeyDBJVUXSMCARDEQ-RVYBPKRDSA-O
InChIInChI=1S/C28H32O17/c1-40-15-3-9(2-13(32)19(15)33)26-16(6-11-12(31)4-10(30)5-14(11)42-26)43-28-25(39)23(37)21(35)18(45-28)8-41-27-24(38)22(36)20(34)17(7-29)44-27/h2-6,17-18,20-25,27-29,34-39H,7-8H2,1H3,(H3-,30,31,32,33)/p+1/t17?,18?,20-,21+,22?,23?,24?,25?,27-,28-/m1/s1
SMILESCOc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2OC(CO[C@@H]3OC(CO)[C@@H](O)C(O)C3O)[C@H](O)C(O)C2O)cc(O)c1O
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Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMPK12010351
lipidmapsM:LMPK12010351 		Petunidin 3-gentiobioside
hmdb:HMDB0038096 Petunidin 3-gentiobioside
2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1lambda⁴-chromen-1-ylium
Petunidin 3-O-gentiobioside
hmdb:HMDB38096 secondary/obsolete/fantasy identifier