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Delphinidin 3-(6''-malonylglucoside) 5-glucoside

PropertiesImageOccurences in reactions
MNX_IDMNXM28104Image of MNXM28104
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC30H33O20
charge1
mass713.15597
referencehmdb:HMDB0039938
InChIKeyKKMPMQKPBOCHRG-YEQKKNNOSA-O
InChIInChI=1S/C30H32O20/c31-7-17-22(39)24(41)26(43)29(49-17)47-15-4-10(32)3-14-11(15)5-16(28(46-14)9-1-12(33)21(38)13(34)2-9)48-30-27(44)25(42)23(40)18(50-30)8-45-20(37)6-19(35)36/h1-5,17-18,22-27,29-31,39-44H,6-8H2,(H4-,32,33,34,35,36,38)/p+1/t17-,18-,22-,23-,24+,25+,26-,27-,29-,30-/m1/s1
SMILESO=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2cc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0039938 Delphinidin 3-(6''-malonylglucoside) 5-glucoside
3-{[(2S,3R,4S,5S,6R)-6-{[(2-carboxyacetyl)oxy]methyl}-3,4,5-trihydroxyoxan-2-yl]oxy}-7-hydroxy-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda⁴-chromen-1-ylium
lipidmaps:LMPK12010336
lipidmapsM:LMPK12010336 		Delphinidin 3-(6-malonylglucoside)-5-glucoside
hmdb:HMDB39938 secondary/obsolete/fantasy identifier