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Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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Cyanidin 3-galactoside-5-glucoside
Properties
Image
Occurences in reactions
MNX_ID
MNXM24311
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
formula
C
27
H
31
O
16
charge
1
mass
611.16066
reference
lipidmapsM:LMPK12010098
InChIKey
RDFLLVCQYHQOBU-ZIMZFXMASA-O
InChI
InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1/t17?,18?,19-,20+,21+,22?,23?,24?,26-,27-/m1/s1
SMILES
OCC1O[C@@H](Oc2cc(O)cc3[o+]c(-c4ccc(O)c(O)c4)c(O[C@@H]4OC(CO)[C@H](O)C(O)C4O)cc23)C(O)[C@@H](O)[C@@H]1O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
lipidmaps:LMPK12010098
lipidmapsM:LMPK12010098
Cyanidin 3-galactoside-5-glucoside