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delphinidin 3-O-rutinoside-7-O-(6-O-(p-hydroxybenzoyl)-glucoside)

MNXM148204 is deprecated and here replaced by MNXM1106807
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1106807Image of MNXM1106807
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC40H44O23
charge0
mass892.22734
referencemetacycM:CPD-16559
InChIKeyLMJXQDNIBLCFED-BXAVUDHBSA-N
InChIInChI=1S/C40H44O23/c1-13-26(45)30(49)33(52)38(58-13)57-12-25-29(48)32(51)35(54)40(63-25)61-23-10-18-19(42)8-17(9-22(18)60-36(23)15-6-20(43)27(46)21(44)7-15)59-39-34(53)31(50)28(47)24(62-39)11-56-37(55)14-2-4-16(41)5-3-14/h2-10,13,24-26,28-35,38-40,45,47-54H,11-12H2,1H3,(H4-,41,42,43,44,46,55)/t13-,24+,25+,26-,28+,29+,30+,31-,32-,33+,34+,35+,38+,39+,40+/m0/s1
SMILESC[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c([O-])cc(O[C@@H]5O[C@H](COC(=O)c6ccc(O)cc6)[C@@H](O)[C@H](O)[C@H]5O)cc4[o+]c3-c3cc(O)c(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
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 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-16559
metacycM:CPD-16559 		delphinidin 3-O-rutinoside-7-O-(6-O-(p-hydroxybenzoyl)-glucoside)